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stringlengths 49
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| first_mask_count
int64 0
16
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int64 0
224
| first_mask_gen_count
int64 1
16
| first_mask_tokens
stringlengths 0
16
| first_mask_gen_count_real
int64 0
18
| generated_smiles
stringlengths 12
256
| original_smiles
stringlengths 12
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| generated_tokens
stringlengths 0
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<|startoftext|><L>CN(C)C(=O)N1CCC(C(=O)N(C)[C<mask_1:4>CN(CCc3ccccc3)C2)CC1<mask_1:4> | 6 | 27 | 4 | @H]2CC | 4 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | @H]2 |
<|startoftext|><L>CN<mask_1:1>O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:1> | 6 | 2 | 1 | (C)C(= | 1 | CN(O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | ( |
<|startoftext|><L>CN(C)<mask_1:7>=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:7> | 2 | 5 | 7 | C( | 7 | CN(C)C(=O)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | C(=O)C( |
<|startoftext|><L>CN(C)<mask_1:6>)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:6> | 4 | 5 | 6 | C(=O | 6 | CN(C)CCC(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CCC(=O |
<|startoftext|><L>CN(C)C(=O)N1CCC(C(<mask_1:1>C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:1> | 5 | 18 | 1 | =O)N( | 1 | CN(C)C(=O)N1CCC(C(=C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | = |
<|startoftext|><L>CN(C)C(=O)<mask_1:5>N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:5> | 0 | 10 | 5 | 5 | CN(C)C(=O)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | C(=O) |
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<|startoftext|><L>CN(C)C(=<mask_1:6>1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:6> | 3 | 8 | 6 | O)N | 7 | CN(C)C(=O)NCCCN1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | O)NCCCN |
<|startoftext|><L>CN(C)C(=O)N1CCC<mask_1:3>(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:3> | 2 | 15 | 3 | (C | 3 | CN(C)C(=O)N1CCC(CC(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | (CC |
<|startoftext|><L>CN(<mask_1:4>N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1<mask_1:4> | 7 | 3 | 4 | C)C(=O) | 4 | CN(C)CCN1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | C)CC |
<|startoftext|><L>CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3<mask_1:5>CC1<mask_1:5> | 4 | 46 | 5 | )C2) | 5 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CCC1 | CN(C)C(=O)N1CCC(C(=O)N(C)[C@H]2CCCN(CCc3ccccc3)C2)CC1 | )C2)C |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccccc<mask_1:4>NS(C)(=O)=O)c1ccc(Br)cc1<mask_1:4> | 1 | 30 | 4 | 1 | 4 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1)C(NS(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | 1)C( |
<|startoftext|><L>CC[C@H]<mask_1:8>=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1<mask_1:8> | 3 | 7 | 8 | (C( | 8 | CC[C@H](NS(=O)(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | (NS(=O)( |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccccc1<mask_1:7>=O)=O)c1ccc(Br)cc1<mask_1:7> | 6 | 31 | 7 | NS(C)( | 8 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1)N(S(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | )N(S(C)( |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccc<mask_1:7>cc1NS(C)(=O)=O)c1ccc(Br)cc1<mask_1:7> | 0 | 28 | 7 | 7 | CC[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1NS(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | (N(C)C) |
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<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc<mask_1:8>1<mask_1:8> | 6 | 48 | 8 | (Br)cc | 8 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(C(C)C)o1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | (C(C)C)o |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C<mask_1:3>ccc1NS(C)(=O)=O)c1ccc(Br)cc1<mask_1:3> | 5 | 22 | 3 | )c1cc | 3 | CC[C@H](C(=O)N[C@@H](C)c1ccc1NS(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | )c1 |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccccc1N<mask_1:7>C)(=O)=O)c1ccc(Br)cc1<mask_1:7> | 2 | 32 | 7 | S( | 7 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NC)N(NS(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | C)N(NS( |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](<mask_1:4>C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1<mask_1:4> | 0 | 21 | 4 | 4 | CC[C@H](C(=O)N[C@@H](C(C)C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | C(C) |
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<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1cc<mask_1:6>1<mask_1:6> | 7 | 47 | 6 | c(Br)cc | 6 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(C)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | c(C)cc |
<|startoftext|><L>CC[C@H](C(=O)N[C@@H](C)c1ccccc1<mask_1:2>=O)=O)c1ccc(Br)cc1<mask_1:2> | 6 | 31 | 2 | NS(C)( | 2 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1S(=O)=O)c1ccc(Br)cc1 | CC[C@H](C(=O)N[C@@H](C)c1ccccc1NS(C)(=O)=O)c1ccc(Br)cc1 | S( |
<|startoftext|><L>O=<mask_1:5>1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1<mask_1:5> | 4 | 2 | 5 | C(Cn | 5 | O=C(CCn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | C(CCn |
<|startoftext|><L>O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCS<mask_1:5>C1<mask_1:5> | 1 | 31 | 5 | C | 5 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCS(=O)CC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | (=O)C |
<|startoftext|><L>O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CC<mask_1:2>CC1<mask_1:2> | 1 | 30 | 2 | S | 2 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCCCCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | CC |
<|startoftext|><L>O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC<mask_1:2>1<mask_1:2> | 0 | 33 | 2 | 2 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCCCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | CC |
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<|startoftext|><L>O=C(Cn1ccnc1)<mask_1:4>1cc(Cl)ccc1N1CCSCC1<mask_1:4> | 2 | 13 | 4 | Nc | 4 | O=C(Cn1ccnc1)NCCc1cc(Cl)ccc1N1CCSCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | NCCc |
<|startoftext|><L>O=C<mask_1:3>Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1<mask_1:3> | 1 | 3 | 3 | ( | 3 | O=C(NCCn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | (NC |
<|startoftext|><L>O=C(Cn1ccn<mask_1:3>c1cc(Cl)ccc1N1CCSCC1<mask_1:3> | 4 | 10 | 3 | c1)N | 3 | O=C(Cn1ccnc1)c1cc(Cl)ccc1N1CCSCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | c1) |
<|startoftext|><L>O=C<mask_1:2>1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1<mask_1:2> | 3 | 3 | 2 | (Cn | 2 | O=C(n1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | (n |
<|startoftext|><L>O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N<mask_1:4>C1<mask_1:4> | 5 | 27 | 4 | 1CCSC | 4 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | 1CCC |
<|startoftext|><L>O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CC<mask_1:2>1<mask_1:2> | 3 | 30 | 2 | SCC | 2 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCCC1 | O=C(Cn1ccnc1)Nc1cc(Cl)ccc1N1CCSCC1 | CC |
<|startoftext|><L>CC(=O)[C@@]12O[C@]1(C)<mask_1:4>@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:4> | 3 | 22 | 4 | C[C | 4 | CC(=O)[C@@]12O[C@]1(C)CC[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC[C |
<|startoftext|><L>CC(=O)[C<mask_1:9>@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:9> | 0 | 8 | 9 | 9 | CC(=O)[C@@H](O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | @@H](O)[C |
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<|startoftext|><L>CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C<mask_1:3>CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:3> | 8 | 46 | 3 | [C@H](O) | 3 | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4CC=CCC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C=C |
<|startoftext|><L>CC(=O)[C@@]12O[C@]1(<mask_1:5>)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:5> | 1 | 20 | 5 | C | 6 | CC(=O)[C@@]12O[C@]1(C)C(=O)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C)C(=O |
<|startoftext|><L>CC(<mask_1:9>=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:9> | 0 | 3 | 9 | 9 | CC(C)OCCCNC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | C)OCCCNC( |
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<|startoftext|><L>CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H]<mask_1:10>4(C)[C@H]3CC[C@]12C<mask_1:10> | 9 | 51 | 10 | (O)CC[C@] | 10 | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | (O)CC[C@@] |
<|startoftext|><L>CC(=O)[C@@]12O[C<mask_1:3>C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:3> | 8 | 16 | 3 | @]1(C)C[ | 3 | CC(=O)[C@@]12O[C]1[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | ]1[ |
<|startoftext|><L>CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@<mask_1:9>CC[C@]12C<mask_1:9> | 3 | 67 | 9 | H]3 | 9 | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@@H]3C(=O)CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | @H]3C(=O) |
<|startoftext|><L>CC(=O)[C@@]12O<mask_1:4>C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:4> | 1 | 14 | 4 | [ | 4 | CC(=O)[C@@]12OCCC[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CCC[ |
<|startoftext|><L>C<mask_1:9>12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C<mask_1:9> | 10 | 1 | 9 | C(=O)[C@@] | 9 | CCOC(=O)CC12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | CC(=O)[C@@]12O[C@]1(C)C[C@@H]1[C@@H]3CC[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C | COC(=O)CC |
<|startoftext|><L>COc1ccc(OC)<mask_1:8>)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1<mask_1:8> | 7 | 11 | 8 | c(NC(=O | 8 | COc1ccc(OC)c(CNC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | c(CNC(=O |
<|startoftext|><L>COc1ccc(OC)c(NC(=<mask_1:9>C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1<mask_1:9> | 10 | 17 | 9 | O)COC(=O)[ | 10 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | O)COC(=O)[ |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O<mask_1:3>2)c1<mask_1:3> | 4 | 64 | 3 | -])C | 3 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | -]) |
<|startoftext|><L>COc1ccc(<mask_1:6>c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1<mask_1:6> | 3 | 8 | 6 | OC) | 6 | COc1ccc(C(C)C)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | C(C)C) |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(N<mask_1:6>cc3[N+](=O)[O-])C2)c1<mask_1:6> | 10 | 41 | 6 | C(=O)c3ccc | 6 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NCc3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | Cc3ccc |
<|startoftext|><L>C<mask_1:10>1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1<mask_1:10> | 2 | 1 | 10 | Oc | 10 | CCOC(=O)COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COC(=O)COc |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O<mask_1:9>)c1<mask_1:9> | 8 | 61 | 9 | )[O-])C2 | 8 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | )[O-])C2 |
<|startoftext|><L>COc1ccc(OC)c(N<mask_1:7>O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1<mask_1:7> | 3 | 14 | 7 | C(= | 7 | COc1ccc(OC)c(NS(=O)(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | S(=O)(= |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O<mask_1:7>3ccccc3[N+](=O)[O-])C2)c1<mask_1:7> | 2 | 45 | 7 | )c | 7 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | )/C=C/c |
<|startoftext|><L>COc1ccc(OC)c(NC(=O)COC(=O)<mask_1:4>H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1<mask_1:4> | 3 | 26 | 4 | [C@ | 4 | COc1ccc(OC)c(NC(=O)COC(=O)[C@@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | COc1ccc(OC)c(NC(=O)COC(=O)[C@H]2CC(=O)N(NC(=O)c3ccccc3[N+](=O)[O-])C2)c1 | [C@@ |
<|startoftext|><L>Nc1c(C(<mask_1:5>C2CCCC2)nnn1-c1cccc(Cl)c1<mask_1:5> | 4 | 7 | 5 | =O)N | 5 | Nc1c(C(=O)NCC2CCCC2)nnn1-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | =O)NC |
<|startoftext|><L>Nc1c(C(=O)NC2CCC<mask_1:2>C2)nnn1-c1cccc(Cl)c1<mask_1:2> | 0 | 16 | 2 | 2 | Nc1c(C(=O)NC2CCCCCC2)nnn1-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | CC |
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<|startoftext|><L>Nc1c(C(=O)NC2CCCC2)nnn1<mask_1:3>-c1cccc(Cl)c1<mask_1:3> | 0 | 23 | 3 | 3 | Nc1c(C(=O)NC2CCCC2)nnn1CCO-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | CCO |
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<|startoftext|><L>Nc1c(C(=O)NC2CCCC2)nnn1-c1c<mask_1:4>l)c1<mask_1:4> | 5 | 27 | 4 | ccc(C | 4 | Nc1c(C(=O)NC2CCCC2)nnn1-c1csc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | sc(C |
<|startoftext|><L>Nc1c(C(=O)NC2CCCC2)nnn1-c1ccc<mask_1:5>)c1<mask_1:5> | 4 | 29 | 5 | c(Cl | 5 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(C=O)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | c(C=O |
<|startoftext|><L>Nc1c(C(=O)NC2CCC<mask_1:3>C2)nnn1-c1cccc(Cl)c1<mask_1:3> | 0 | 16 | 3 | 3 | Nc1c(C(=O)NC2CCCCCCC2)nnn1-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | CCC |
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<|startoftext|><L>Nc1c(C<mask_1:5>NC2CCCC2)nnn1-c1cccc(Cl)c1<mask_1:5> | 4 | 6 | 5 | (=O) | 5 | Nc1c(CC(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | C(=O) |
<|startoftext|><L>Nc1c(C(=O)NC2CCCC2)nnn1-c1cc<mask_1:5>Cl)c1<mask_1:5> | 3 | 28 | 5 | cc( | 5 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(OCCl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | cc(OC |
<|startoftext|><L>Nc1c(C(=O)NC<mask_1:4>2CCCC2)nnn1-c1cccc(Cl)c1<mask_1:4> | 0 | 12 | 4 | 4 | Nc1c(C(=O)NCCCOC2CCCC2)nnn1-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | CCOC |
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<|startoftext|><L>Nc1c(C(=O)NC2C<mask_1:1>CCC2)nnn1-c1cccc(Cl)c1<mask_1:1> | 0 | 14 | 1 | 1 | Nc1c(C(=O)NC2CCCCC2)nnn1-c1cccc(Cl)c1 | Nc1c(C(=O)NC2CCCC2)nnn1-c1cccc(Cl)c1 | C |
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<|startoftext|><L>CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)<mask_1:6>c1nnc2ccccn12<mask_1:6> | 0 | 41 | 6 | 6 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)C(=O)Nc1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | C(=O)N |
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<|startoftext|><L>CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccc<mask_1:4>n12<mask_1:4> | 1 | 50 | 4 | c | 4 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2cccc(O)n12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | c(O) |
<|startoftext|><L>CC<mask_1:3>(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:3> | 0 | 2 | 3 | 3 | CC(C)(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | (C) |
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<|startoftext|><L>CC(C)[C@H](<mask_1:5>=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:5> | 3 | 11 | 5 | NC( | 5 | CC(C)[C@H](NCCC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | NCCC( |
<|startoftext|><L>CC<mask_1:1>(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:1> | 0 | 2 | 1 | 1 | CCC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | C |
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<|startoftext|><L>CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2C<mask_1:6>C1)c1nnc2ccccn12<mask_1:6> | 7 | 31 | 6 | C(C)(C) | 6 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2C(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | (C)(C) |
<|startoftext|><L>CC(C)[C@H](NC<mask_1:6>N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:6> | 4 | 13 | 6 | (=O) | 6 | CC(C)[C@H](NC(=O)CCN1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | (=O)CC |
<|startoftext|><L><mask_1:3>H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:3> | 8 | 0 | 3 | CC(C)[C@ | 3 | C[CH](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | C[C |
<|startoftext|><L>CC(C)[C@H]<mask_1:4>1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:4> | 8 | 10 | 4 | (NC(=O)N | 4 | CC(C)[C@H](CCN1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | (CCN |
<|startoftext|><L>CC(C)[C@H](NC(=O)N1Cc2<mask_1:5>nH]nc2CC(C)(C)C1)c1nnc2ccccn12<mask_1:5> | 2 | 22 | 5 | c[ | 5 | CC(C)[C@H](NC(=O)N1Cc2c(C)[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | CC(C)[C@H](NC(=O)N1Cc2c[nH]nc2CC(C)(C)C1)c1nnc2ccccn12 | c(C)[ |
<|startoftext|><L>COC(=O)[C@@H](C)N1C(<mask_1:3>=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:3> | 7 | 20 | 3 | =O)S/C( | 3 | COC(=O)[C@@H](C)N1C(O/N=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | O/N |
<|startoftext|><L>COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C<mask_1:5>c2)C1=O<mask_1:5> | 2 | 42 | 5 | )c | 5 | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)c(I)c2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | )c(I) |
<|startoftext|><L>COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2<mask_1:4>cc(OC(C)C)cc2)C1=O<mask_1:4> | 1 | 32 | 4 | c | 4 | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2c(I)cc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | c(I) |
<|startoftext|><L>COC<mask_1:5>[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:5> | 4 | 3 | 5 | (=O) | 5 | COC(=O)C[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | (=O)C |
<|startoftext|><L>COC(=O)<mask_1:7>@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:7> | 2 | 7 | 7 | [C | 7 | COC(=O)C(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | C(=O)[C |
<|startoftext|><L>COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2<mask_1:5>1=O<mask_1:5> | 2 | 46 | 5 | )C | 5 | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2OC)CC1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | OC)CC |
<|startoftext|><L>COC(=O)<mask_1:6>C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:6> | 1 | 7 | 6 | [ | 6 | COC(=O)C(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | C(=O)[ |
<|startoftext|><L>COC(=<mask_1:6>C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:6> | 3 | 5 | 6 | O)[ | 6 | COC(=O)CCC[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | O)CCC[ |
<|startoftext|><L>COC(=O)[C@<mask_1:6>)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:6> | 5 | 10 | 6 | @H](C | 6 | COC(=O)[C@@H](CO)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | @H](CO |
<|startoftext|><L>COC(=O)[C@@H](C)<mask_1:4>S/C(=C/c2ccc(OC(C)C)cc2)C1=O<mask_1:4> | 7 | 16 | 4 | N1C(=O) | 4 | COC(=O)[C@@H](C)N1C=S/C(=C/c2ccc(OC(C)C)cc2)C1=O | COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2ccc(OC(C)C)cc2)C1=O | N1C= |
<|startoftext|><L>CC<mask_1:3>1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:3> | 4 | 2 | 3 | (C)c | 3 | CCCOc1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | COc |
<|startoftext|><L>CC(C)c1ccc([C@@H](C)NC<mask_1:6>@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:6> | 7 | 22 | 6 | (=O)[C@ | 6 | CC(C)c1ccc([C@@H](C)NC(=O)[C@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | (=O)[C |
<|startoftext|><L>CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C<mask_1:1>)cc1<mask_1:1> | 7 | 42 | 1 | [C@H]2N | 1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C2)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | 2 |
<|startoftext|><L>CC(C)c1ccc([C@@H](C)NC(=O)<mask_1:4>C@@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:4> | 1 | 26 | 4 | [ | 4 | CC(C)c1ccc([C@@H](C)NC(=O)NCC[C@@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | NCC[ |
<|startoftext|><L>CC<mask_1:5>c([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:5> | 7 | 2 | 5 | (C)c1cc | 5 | CCOc1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | Oc1cc |
<|startoftext|><L>CC(<mask_1:2>)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:2> | 1 | 3 | 2 | C | 2 | CC(=O)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | =O |
<|startoftext|><L>CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2C<mask_1:3>)C[C@H]2N)cc1<mask_1:3> | 6 | 34 | 3 | C(F)(F | 3 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CN(C)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | N(C |
<|startoftext|><L>CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]<mask_1:7>)cc1<mask_1:7> | 2 | 47 | 7 | 2N | 7 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2C(=O)O)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | 2C(=O)O |
<|startoftext|><L>CC(C)c1ccc([C@<mask_1:1>(C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:1> | 3 | 14 | 1 | @H] | 1 | CC(C)c1ccc([C@](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | ] |
<|startoftext|><L>CC(C<mask_1:3>cc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1<mask_1:3> | 4 | 4 | 3 | )c1c | 3 | CC(C)n1cc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | CC(C)c1ccc([C@@H](C)NC(=O)[C@@H]2CC(F)(F)C[C@H]2N)cc1 | )n1 |
<|startoftext|><L>COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)<mask_1:8>2ccc([N+](=O)[O-])cc2nc1O<mask_1:8> | 9 | 45 | 8 | [O-])c1nc | 8 | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1n2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | [O-])c1n |
<|startoftext|><L>CO<mask_1:5>(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:5> | 1 | 2 | 5 | C | 5 | COCCCNC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | CCCNC |
<|startoftext|><L>COC(=O)C(=O)[C@H]<mask_1:3>=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:3> | 8 | 17 | 3 | (C(=O)C( | 3 | COC(=O)C(=O)[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | (C( |
<|startoftext|><L>CO<mask_1:7>(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:7> | 6 | 2 | 7 | C(=O)C | 7 | COC(=O)NC(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | C(=O)NC |
<|startoftext|><L>COC(=O)C(=O)[C@H](C(=O)C(=<mask_1:10>ccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:10> | 7 | 26 | 10 | O)Nc1cc | 10 | COC(=O)C(=O)[C@H](C(=O)C(=O)c1c(OC)cccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | O)c1c(OC)c |
<|startoftext|><L>C<mask_1:3>)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:3> | 10 | 1 | 3 | OC(=O)C(=O | 3 | CC(C)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | C(C |
<|startoftext|><L>C<mask_1:6>O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:6> | 9 | 1 | 6 | OC(=O)C(= | 6 | CCCNC(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | CCNC(= |
<|startoftext|><L>COC(=O)C(=O)[C@H](C(=O)C(=O)<mask_1:8>Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:8> | 0 | 28 | 8 | 8 | COC(=O)C(=O)[C@H](C(=O)C(=O)c1ccccc1Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | c1ccccc1 |
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<|startoftext|><L>COC(=O)C(=O)[C@H]<mask_1:1>C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:1> | 6 | 17 | 1 | (C(=O) | 1 | COC(=O)C(=O)[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | ( |
<|startoftext|><L>COC(=O)C(=O)[C@H](C(=O)C(=O)N<mask_1:6>cc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O<mask_1:6> | 5 | 29 | 6 | c1ccc | 6 | COC(=O)C(=O)[C@H](C(=O)C(=O)NNc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | COC(=O)C(=O)[C@H](C(=O)C(=O)Nc1ccccc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2nc1O | Nc1ccc |