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int64 0
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| generated_smiles
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| original_smiles
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<|startoftext|><L>Cn1cc(C(<mask_1:7>CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:7> | 5 | 8 | 7 | =O)N2 | 7 | Cn1cc(C(=O)N2CCCC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | =O)N2CC |
<|startoftext|><L>Cn1cc(C(=O)<mask_1:4>2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:4> | 1 | 11 | 4 | N | 4 | Cn1cc(C(=O)OCCN2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | OCCN |
<|startoftext|><L><mask_1:5>c(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:5> | 4 | 0 | 5 | Cn1c | 5 | CCn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | CCn1c |
<|startoftext|><L>Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CC<mask_1:5>2)ccc1=O<mask_1:5> | 4 | 38 | 5 | CN)C | 5 | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CC3CC3)2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | 3CC3) |
<|startoftext|><L>Cn1cc(C(=O)<mask_1:3>[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:3> | 4 | 11 | 3 | N2CC | 3 | Cn1cc(C(=O)N2C[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | N2C |
<|startoftext|><L>Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2<mask_1:5>1=O<mask_1:5> | 4 | 43 | 5 | )ccc | 4 | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | )ccc |
<|startoftext|><L>Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CC<mask_1:3>2)ccc1=O<mask_1:3> | 4 | 38 | 3 | CN)C | 3 | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCO)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | O)C |
<|startoftext|><L>Cn1cc(C(=O)N2CC[C@H]3<mask_1:1>[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:1> | 0 | 21 | 1 | 1 | Cn1cc(C(=O)N2CC[C@H]3C[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | C |
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<|startoftext|><L>Cn1cc(<mask_1:1>N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:1> | 5 | 6 | 1 | C(=O) | 1 | Cn1cc(CN2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | C |
<|startoftext|><L>Cn1cc(C(=<mask_1:5>N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O<mask_1:5> | 2 | 9 | 5 | O) | 5 | Cn1cc(C(=O)NCCN2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | Cn1cc(C(=O)N2CC[C@H]3[C@H](CCC(=O)N3CCCN)C2)ccc1=O | O)NCC |
<|startoftext|><L>CC(C)CCNc1ccc<mask_1:4>(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:4> | 2 | 13 | 4 | (S | 4 | CC(C)CCNc1ccc(CNS(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | (CNS |
<|startoftext|><L>CC(C<mask_1:6>Nc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:6> | 3 | 4 | 6 | )CC | 6 | CC(C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | )C(=O) |
<|startoftext|><L>CC(C)C<mask_1:5>ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:5> | 4 | 6 | 5 | CNc1 | 5 | CC(C)CCCOc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CCOc1 |
<|startoftext|><L>CC(C)CCNc1ccc(<mask_1:2>(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:2> | 1 | 14 | 2 | S | 2 | CC(C)CCNc1ccc(CS(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CS |
<|startoftext|><L>CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2<mask_1:6>(=O)O<mask_1:6> | 5 | 31 | 6 | )cc1C | 6 | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1CC(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | )cc1CC |
<|startoftext|><L>CC(C)CCNc1ccc(S(=O)(=O)NC2<mask_1:4>CCC2)cc1C(=O)O<mask_1:4> | 1 | 26 | 4 | C | 4 | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCCCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CCCC |
<|startoftext|><L>CC(C)C<mask_1:6>1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:6> | 3 | 6 | 6 | CNc | 6 | CC(C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | (=O)Nc |
<|startoftext|><L>CC(C)<mask_1:5>Nc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:5> | 2 | 5 | 5 | CC | 5 | CC(C)C(=O)Nc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | C(=O) |
<|startoftext|><L>CC(C)CCNc1ccc(S(=O)(=O)<mask_1:4>CCCC2)cc1C(=O)O<mask_1:4> | 3 | 23 | 4 | NC2 | 4 | CC(C)CCNc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | N2CC |
<|startoftext|><L>CC(C<mask_1:3>CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O<mask_1:3> | 1 | 4 | 3 | ) | 3 | CC(C)=CCCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | CC(C)CCNc1ccc(S(=O)(=O)NC2CCCC2)cc1C(=O)O | )=C |
<|startoftext|><L><mask_1:2>(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1<mask_1:2> | 3 | 0 | 2 | COC | 2 | NC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | NC |
<|startoftext|><L>COC(=O)[<mask_1:4>NC(=O)OC(C)(C)C)Cc1cccc(Br)c1<mask_1:4> | 6 | 8 | 4 | C@H](C | 4 | COC(=O)[C@](NC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | C@]( |
<|startoftext|><L>COC(=O)[C@H](CNC(=O)OC(C)(C)C)C<mask_1:4>ccc(Br)c1<mask_1:4> | 3 | 31 | 4 | c1c | 4 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)COc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | Oc1c |
<|startoftext|><L>COC(=O)<mask_1:6>[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1<mask_1:6> | 0 | 7 | 6 | 6 | COC(=O)CN(C)C[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | CN(C)C |
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<|startoftext|><L>COC(=O)[C@H](C<mask_1:2>)OC(C)(C)C)Cc1cccc(Br)c1<mask_1:2> | 5 | 14 | 2 | NC(=O | 2 | COC(=O)[C@H](C(C)OC(C)(C)C)Cc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | (C |
<|startoftext|><L>COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cc<mask_1:2>r)c1<mask_1:2> | 4 | 35 | 2 | cc(B | 2 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | (B |
<|startoftext|><L>COC(=O)[C@H](CNC(=O)OC(C)(C)C)<mask_1:5>1cccc(Br)c1<mask_1:5> | 2 | 30 | 5 | Cc | 5 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)NCCCc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | NCCCc |
<|startoftext|><L>COC(=O)[C@H](CNC(=O)OC<mask_1:6>(C)C)Cc1cccc(Br)c1<mask_1:6> | 3 | 22 | 6 | (C) | 6 | COC(=O)[C@H](CNC(=O)OCC[C@H](C)C)Cc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | C[C@H] |
<|startoftext|><L>COC(=O)[C@H](CNC(=O)OC(C)(C)C<mask_1:4>Cc1cccc(Br)c1<mask_1:4> | 1 | 29 | 4 | ) | 4 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)NCCCc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | )NCC |
<|startoftext|><L>COC(<mask_1:6>[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1<mask_1:6> | 3 | 4 | 6 | =O) | 6 | COC(=O)CCC[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | COC(=O)[C@H](CNC(=O)OC(C)(C)C)Cc1cccc(Br)c1 | =O)CCC |
<|startoftext|><L>CC(C)<mask_1:3>)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1<mask_1:3> | 4 | 5 | 3 | C(=O | 3 | CC(C)(CO)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | (CO |
<|startoftext|><L>CC(C)C(=O)N1CCC(<mask_1:3>C(=O)c2c[nH]c3ccccc23)CC1<mask_1:3> | 1 | 16 | 3 | N | 3 | CC(C)C(=O)N1CCC(CCNC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CCN |
<|startoftext|><L>CC(C)C(<mask_1:5>1CCC(NC(=O)c2c[nH]c3ccccc23)CC1<mask_1:5> | 4 | 7 | 5 | =O)N | 5 | CC(C)C(=O)NC1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | =O)NC |
<|startoftext|><L>CC(C)C(=O)N1CCC(N<mask_1:5>)c2c[nH]c3ccccc23)CC1<mask_1:5> | 4 | 17 | 5 | C(=O | 5 | CC(C)C(=O)N1CCC(NCC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CC(=O |
<|startoftext|><L>CC(C)C(=O)N1CCC(NC(=O<mask_1:3>2c[nH]c3ccccc23)CC1<mask_1:3> | 2 | 21 | 3 | )c | 3 | CC(C)C(=O)N1CCC(NC(=O)Cc2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | )Cc |
<|startoftext|><L>CC(C)C<mask_1:2>CCC(NC(=O)c2c[nH]c3ccccc23)CC1<mask_1:2> | 6 | 6 | 2 | (=O)N1 | 2 | CC(C)CN1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | N1 |
<|startoftext|><L>CC(C)C(=O)N1CCC(N<mask_1:4>(=O)c2c[nH]c3ccccc23)CC1<mask_1:4> | 1 | 17 | 4 | C | 4 | CC(C)C(=O)N1CCC(NCCNC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CCNC |
<|startoftext|><L>CC(C)C<mask_1:4>)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1<mask_1:4> | 3 | 6 | 4 | (=O | 4 | CC(C)CC(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | C(=O |
<|startoftext|><L>CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3<mask_1:3>3)CC1<mask_1:3> | 6 | 31 | 3 | ccccc2 | 3 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3c2C3)CC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | c2C |
<|startoftext|><L>CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)<mask_1:6>C1<mask_1:6> | 1 | 39 | 6 | C | 6 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)C(=O)NC1 | CC(C)C(=O)N1CCC(NC(=O)c2c[nH]c3ccccc23)CC1 | C(=O)N |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc<mask_1:7>)NCC(F)(F)F<mask_1:7> | 3 | 42 | 7 | 1Cl | 7 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)NC(=O)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | 1)NC(=O |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NC<mask_1:7>(F)(F)F<mask_1:7> | 1 | 48 | 7 | C | 7 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(=O)NC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | C(=O)NC |
<|startoftext|><L>O=C(COC(<mask_1:7>c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F<mask_1:7> | 3 | 8 | 7 | =O) | 7 | O=C(COC(=O)/C=Cc1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | =O)/C=C |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)<mask_1:1>C(F)(F)F<mask_1:1> | 2 | 46 | 1 | NC | 1 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | N |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N<mask_1:2>Cc1ccccc1Cl)NCC(F)(F)F<mask_1:2> | 0 | 34 | 2 | 2 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCCc1ccccc1Cl)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | CC |
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<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N<mask_1:5>c1ccccc1Cl)NCC(F)(F)F<mask_1:5> | 1 | 34 | 5 | C | 5 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NC(=O)c1ccccc1Cl)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | C(=O) |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N<mask_1:3>ccc1Cl)NCC(F)(F)F<mask_1:3> | 5 | 34 | 3 | Cc1cc | 3 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Nc1sccc1Cl)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | c1s |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc<mask_1:6>c1ccccc1Cl)NCC(F)(F)F<mask_1:6> | 3 | 32 | 6 | 1NC | 5 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCOc1ccccc1Cl)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | 1NCCO |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)<mask_1:4>(F)F<mask_1:4> | 6 | 46 | 4 | NCC(F) | 4 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)C(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | C(F) |
<|startoftext|><L>O=C(COC(=O)c1cc([N+](=O)[O-])ccc1<mask_1:5>c1Cl)NCC(F)(F)F<mask_1:5> | 8 | 33 | 5 | NCc1cccc | 5 | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCc1Cl)NCC(F)(F)F | O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl)NCC(F)(F)F | N1CCC |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC)CC(=O<mask_1:3>Cc3ccccc3C2)cc1<mask_1:3> | 4 | 28 | 3 | )N2C | 3 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2Cc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | )N2 |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC)CC(=O)<mask_1:6>cccc3C2)cc1<mask_1:6> | 7 | 29 | 6 | N2CCc3c | 6 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2Cc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | N2Cc3c |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2<mask_1:6>c1<mask_1:6> | 2 | 43 | 6 | )c | 6 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)c(Cl)c1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | )c(Cl) |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)<mask_1:4>c1<mask_1:4> | 1 | 44 | 4 | c | 4 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)c(C)c1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | c(C) |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC<mask_1:3>C(=O)N2CCc3ccccc3C2)cc1<mask_1:3> | 2 | 22 | 3 | )C | 3 | CCOc1ccc(S(=O)(=O)N(CC#N)C(=O)N2CCc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | #N) |
<|startoftext|><L>CCOc1cc<mask_1:5>S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1<mask_1:5> | 2 | 7 | 5 | c( | 5 | CCOc1ccc(CCNS(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | c(CCN |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC)<mask_1:5>2CCc3ccccc3C2)cc1<mask_1:5> | 7 | 23 | 5 | CC(=O)N | 5 | CCOc1ccc(S(=O)(=O)N(CC)[C@H]2CCc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | [C@H] |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(<mask_1:3>(=O)N2CCc3ccccc3C2)cc1<mask_1:3> | 5 | 20 | 3 | CC)CC | 3 | CCOc1ccc(S(=O)(=O)N(C)C(=O)N2CCc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | C)C |
<|startoftext|><L>CC<mask_1:7>1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1<mask_1:7> | 2 | 2 | 7 | Oc | 7 | CCOC(=O)c1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | OC(=O)c |
<|startoftext|><L>CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C<mask_1:5>)cc1<mask_1:5> | 1 | 42 | 5 | 2 | 5 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2(C)C)cc1 | CCOc1ccc(S(=O)(=O)N(CC)CC(=O)N2CCc3ccccc3C2)cc1 | 2(C)C |
<|startoftext|><L>CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(<mask_1:3>c(C#N)c21<mask_1:3> | 2 | 33 | 3 | C) | 3 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(OC)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | OC) |
<|startoftext|><L>CCO<mask_1:4>O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21<mask_1:4> | 3 | 3 | 4 | C(= | 4 | CCONC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | NC(= |
<|startoftext|><L>CCOC(=O)Cn1c2ccccc2c(=O)c2cc<mask_1:3>C)c(C#N)c21<mask_1:3> | 5 | 28 | 3 | (C)c( | 3 | CCOC(=O)Cn1c2ccccc2c(=O)c2ccc(OC)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | c(O |
<|startoftext|><L>CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C<mask_1:6>N)c21<mask_1:6> | 5 | 34 | 6 | )c(C# | 6 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(Cl)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | l)c(C# |
<|startoftext|><L>CC<mask_1:5>Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21<mask_1:5> | 6 | 2 | 5 | OC(=O) | 5 | CC(C)=CCn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | (C)=C |
<|startoftext|><L>CC<mask_1:4>C(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21<mask_1:4> | 1 | 2 | 4 | O | 4 | CCCCCNC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCCN |
<|startoftext|><L>CCOC(=O)Cn<mask_1:3>c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21<mask_1:3> | 1 | 10 | 3 | 1 | 3 | CCOC(=O)Cn1cnc2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | 1cn |
<|startoftext|><L>C<mask_1:5>(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21<mask_1:5> | 3 | 1 | 5 | COC | 5 | CN(C)C(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | N(C)C |
<|startoftext|><L>CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(<mask_1:5>N)c21<mask_1:5> | 6 | 33 | 5 | C)c(C# | 5 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(CN)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | C)c(C |
<|startoftext|><L>CCOC<mask_1:3>n1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21<mask_1:3> | 5 | 4 | 3 | (=O)C | 3 | CCOCCOCn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | CCOC(=O)Cn1c2ccccc2c(=O)c2cc(C)c(C)c(C#N)c21 | COC |
<|startoftext|><L>O=C(O)C[C@@H]1COCCN1C(=O)C<mask_1:4>N1CCCCO1<mask_1:4> | 1 | 26 | 4 | C | 4 | O=C(O)C[C@@H]1COCCN1C(=O)C(=O)N1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | (=O) |
<|startoftext|><L>O=C(O)C[C@@H]1COCCN1C(=O)C<mask_1:4>N1CCCCO1<mask_1:4> | 1 | 26 | 4 | C | 4 | O=C(O)C[C@@H]1COCCN1C(=O)CCCCCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | CCCC |
<|startoftext|><L>O=C(O)C[C@@<mask_1:3>CCN1C(=O)CCN1CCCCO1<mask_1:3> | 5 | 11 | 3 | H]1CO | 3 | O=C(O)C[C@@H]1CCN1C(=O)CCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | H]1 |
<|startoftext|><L>O=C(O)<mask_1:1>C[C@@H]1COCCN1C(=O)CCN1CCCCO1<mask_1:1> | 0 | 6 | 1 | 1 | O=C(O)CC[C@@H]1COCCN1C(=O)CCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | C |
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<|startoftext|><L>O=C(O)C[C@@H]1COCCN1C(=O)CC<mask_1:4>N1CCCCO1<mask_1:4> | 0 | 27 | 4 | 4 | O=C(O)C[C@@H]1COCCN1C(=O)CC(=O)N1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | (=O) |
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<|startoftext|><L>O=C(O)C[C@@H]1COCCN1<mask_1:2>(=O)CCN1CCCCO1<mask_1:2> | 1 | 20 | 2 | C | 2 | O=C(O)C[C@@H]1COCCN1CC(=O)CCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | CC |
<|startoftext|><L>O=C(O)C[C@@<mask_1:4>]1COCCN1C(=O)CCN1CCCCO1<mask_1:4> | 1 | 11 | 4 | H | 4 | O=C(O)C[C@@H][n]1COCCN1C(=O)CCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | H][n |
<|startoftext|><L>O=C(O)C[C@@H<mask_1:4>OCCN1C(=O)CCN1CCCCO1<mask_1:4> | 3 | 12 | 4 | ]1C | 4 | O=C(O)C[C@@H]1CCOCCN1C(=O)CCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | ]1CC |
<|startoftext|><L>O=C(O)C[C@@H]<mask_1:2>CN1C(=O)CCN1CCCCO1<mask_1:2> | 4 | 13 | 2 | 1COC | 2 | O=C(O)C[C@@H]1CCN1C(=O)CCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | 1C |
<|startoftext|><L>O=C(O)C[C@@H]1COCCN1C(=O)C<mask_1:2>N1CCCCO1<mask_1:2> | 1 | 26 | 2 | C | 2 | O=C(O)C[C@@H]1COCCN1C(=O)CCCN1CCCCO1 | O=C(O)C[C@@H]1COCCN1C(=O)CCN1CCCCO1 | CC |
<|startoftext|><L>Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3cccc<mask_1:5>c23)c1<mask_1:5> | 0 | 34 | 5 | 5 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3cccc(C#N)c23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | (C#N) |
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<|startoftext|><L>Cc1ccc(<mask_1:3>c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1<mask_1:3> | 2 | 7 | 3 | C) | 3 | Cc1ccc(Cl)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | Cl) |
<|startoftext|><L>Cc1ccc(C)c(OC<mask_1:6>O)Cc2c[nH]c3ccccc23)c1<mask_1:6> | 5 | 13 | 6 | COC(= | 6 | Cc1ccc(C)c(OCCCNC(=O)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | CCNC(= |
<|startoftext|><L>C<mask_1:4>cc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1<mask_1:4> | 3 | 1 | 4 | c1c | 4 | COc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | Oc1c |
<|startoftext|><L>Cc1ccc(C)c(<mask_1:2>CCOC(=O)Cc2c[nH]c3ccccc23)c1<mask_1:2> | 1 | 11 | 2 | O | 2 | Cc1ccc(C)c(OCCCOC(=O)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | OC |
<|startoftext|><L>Cc1ccc(C)c(OCCOC(=O)Cc2<mask_1:2>c3ccccc23)c1<mask_1:2> | 5 | 23 | 2 | c[nH] | 2 | Cc1ccc(C)c(OCCOC(=O)Cc2csc3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | cs |
<|startoftext|><L>Cc1ccc(C)c(OCCOC(=<mask_1:6>Cc2c[nH]c3ccccc23)c1<mask_1:6> | 2 | 18 | 6 | O) | 6 | Cc1ccc(C)c(OCCOC(=O)N(C)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | O)N(C) |
<|startoftext|><L>Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccc<mask_1:5>cc23)c1<mask_1:5> | 0 | 33 | 5 | 5 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccc(C#N)cc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | (C#N) |
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<|startoftext|><L>Cc1ccc(C)c(OCC<mask_1:3>OC(=O)Cc2c[nH]c3ccccc23)c1<mask_1:3> | 0 | 14 | 3 | 3 | Cc1ccc(C)c(OCCOCCOC(=O)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | OCC |
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<|startoftext|><L>Cc1ccc(C)c(OCCOC(<mask_1:2>O)Cc2c[nH]c3ccccc23)c1<mask_1:2> | 1 | 17 | 2 | = | 2 | Cc1ccc(C)c(OCCOC(=NO)Cc2c[nH]c3ccccc23)c1 | Cc1ccc(C)c(OCCOC(=O)Cc2c[nH]c3ccccc23)c1 | =N |
<|startoftext|><L>C[C@@H]1CCCC[C@@<mask_1:6>(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:6> | 5 | 16 | 6 | H]1NC | 6 | C[C@@H]1CCCC[C@@H]1CNC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | H]1CNC |
<|startoftext|><L>C[C@<mask_1:5>C[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:5> | 7 | 4 | 5 | @H]1CCC | 5 | C[C@H]1OCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | H]1OC |
<|startoftext|><L>C[C@@H]1C<mask_1:3>H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:3> | 7 | 9 | 3 | CCC[C@@ | 3 | C[C@@H]1C[C@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | [C@ |
<|startoftext|><L>C[C@@H]1CC<mask_1:4>[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:4> | 2 | 10 | 4 | CC | 4 | C[C@@H]1CCC(C)[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C(C) |
<|startoftext|><L><mask_1:2>C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:2> | 0 | 0 | 2 | 2 | N#C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | N# |
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<|startoftext|><L>C[C@@H]1CCCC[C@@H]1<mask_1:3>(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:3> | 2 | 19 | 3 | NC | 3 | C[C@@H]1CCCC[C@@H]1CNC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | CNC |
<|startoftext|><L>C[C@@H]1CCCC[C@@H]1NC(=O)C<mask_1:4>(=O)(=O)c1ccc(I)cc1<mask_1:4> | 2 | 26 | 4 | NS | 4 | C[C@@H]1CCCC[C@@H]1NC(=O)CCCNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | CCNS |
<|startoftext|><L>C[C@@H]1CCCC[C@@H]1NC(<mask_1:4>(=O)(=O)c1ccc(I)cc1<mask_1:4> | 6 | 22 | 4 | =O)CNS | 4 | C[C@@H]1CCCC[C@@H]1NC(=O)S(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | =O)S |
<|startoftext|><L>C[C@@H]1C<mask_1:4>@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1<mask_1:4> | 6 | 9 | 4 | CCC[C@ | 4 | C[C@@H]1CCC[C@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | CC[C |
<|startoftext|><L>C[C@@H]1CCCC[C@@H]1N<mask_1:2>)CNS(=O)(=O)c1ccc(I)cc1<mask_1:2> | 4 | 20 | 2 | C(=O | 2 | C[C@@H]1CCCC[C@@H]1N(C)CNS(=O)(=O)c1ccc(I)cc1 | C[C@@H]1CCCC[C@@H]1NC(=O)CNS(=O)(=O)c1ccc(I)cc1 | (C |