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stringlengths 48
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| first_mask_count
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| first_mask_gen_count
int64 1
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| first_mask_gen_count_real
int64 0
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| generated_smiles
stringlengths 11
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| original_smiles
stringlengths 11
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<|startoftext|><L>CCCOc1ccc(NC(=O<mask_1:3>CCOC)cc1Cl<mask_1:3> | 1 | 15 | 3 | ) | 3 | CCCOc1ccc(NC(=O)NCCCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | )NC |
<|startoftext|><L>CCCOc1ccc(NC(=O)CCO<mask_1:2>)cc1Cl<mask_1:2> | 1 | 19 | 2 | C | 2 | CCCOc1ccc(NC(=O)CCOCC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | CC |
<|startoftext|><L>CCCOc1ccc(NC<mask_1:1>O)CCOC)cc1Cl<mask_1:1> | 2 | 12 | 1 | (= | 1 | CCCOc1ccc(NC(O)CCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | ( |
<|startoftext|><L>CCCOc1ccc(NC(=O)<mask_1:1>CCOC)cc1Cl<mask_1:1> | 0 | 16 | 1 | 1 | CCCOc1ccc(NC(=O)NCCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | N |
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<|startoftext|><L><mask_1:1>Oc1ccc(NC(=O)CCOC)cc1Cl<mask_1:1> | 3 | 0 | 1 | CCC | 1 | COc1ccc(NC(=O)CCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | C |
<|startoftext|><L>CCCO<mask_1:2>1ccc(NC(=O)CCOC)cc1Cl<mask_1:2> | 1 | 4 | 2 | c | 2 | CCCOCc1ccc(NC(=O)CCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | Cc |
<|startoftext|><L>CCCOc1ccc<mask_1:2>NC(=O)CCOC)cc1Cl<mask_1:2> | 1 | 9 | 2 | ( | 2 | CCCOc1ccc(CNC(=O)CCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | (C |
<|startoftext|><L>CCCOc1ccc(NC(=<mask_1:3>CCOC)cc1Cl<mask_1:3> | 2 | 14 | 3 | O) | 3 | CCCOc1ccc(NC(=O)CCCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | O)C |
<|startoftext|><L>CCCOc1ccc(N<mask_1:3>(=O)CCOC)cc1Cl<mask_1:3> | 1 | 11 | 3 | C | 3 | CCCOc1ccc(N(C)(=O)CCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | (C) |
<|startoftext|><L>CCC<mask_1:2>ccc(NC(=O)CCOC)cc1Cl<mask_1:2> | 3 | 3 | 2 | Oc1 | 2 | CCCc1ccc(NC(=O)CCOC)cc1Cl | CCCOc1ccc(NC(=O)CCOC)cc1Cl | c1 |
<|startoftext|><L>Cn1cncc1C(=O)N1[C@<mask_1:2>2CCCC[C@H]2C[C@H]1C(=O)O<mask_1:2> | 3 | 18 | 2 | @H] | 2 | Cn1cncc1C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | H] |
<|startoftext|><L><mask_1:5>Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O<mask_1:5> | 0 | 0 | 5 | 5 | CC(C)Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | CC(C) |
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<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H]2C<mask_1:5>CCC[C@H]2C[C@H]1C(=O)O<mask_1:5> | 0 | 23 | 5 | 5 | Cn1cncc1C(=O)N1[C@@H]2C(=O)CCCC[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | (=O)C |
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<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H]2CCCC[<mask_1:3>2C[C@H]1C(=O)O<mask_1:3> | 4 | 27 | 3 | C@H] | 3 | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | C@] |
<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H]2<mask_1:6>[C@H]2C[C@H]1C(=O)O<mask_1:6> | 4 | 22 | 6 | CCCC | 6 | Cn1cncc1C(=O)N1[C@@H]2CC(O)C[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | CC(O)C |
<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H<mask_1:5>[C@H]2C[C@H]1C(=O)O<mask_1:5> | 6 | 20 | 5 | ]2CCCC | 5 | Cn1cncc1C(=O)N1[C@@H]2CCO[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | ]2CCO |
<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H]2CCCC[C<mask_1:1>@H]2C[C@H]1C(=O)O<mask_1:1> | 0 | 28 | 1 | 1 | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | @ |
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<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H]2<mask_1:4>C@H]2C[C@H]1C(=O)O<mask_1:4> | 5 | 22 | 4 | CCCC[ | 4 | Cn1cncc1C(=O)N1[C@@H]2CCC[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | CCC[ |
<|startoftext|><L>Cn1cncc1C(=O)N1[C@@H]2CCC<mask_1:5>C@H]2C[C@H]1C(=O)O<mask_1:5> | 2 | 25 | 5 | C[ | 5 | Cn1cncc1C(=O)N1[C@@H]2CCCN(C)[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | N(C)[ |
<|startoftext|><L>Cn1cncc1C(=O)<mask_1:4>C@@H]2CCCC[C@H]2C[C@H]1C(=O)O<mask_1:4> | 3 | 13 | 4 | N1[ | 4 | Cn1cncc1C(=O)N1C[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | Cn1cncc1C(=O)N1[C@@H]2CCCC[C@H]2C[C@H]1C(=O)O | N1C[ |
<|startoftext|><L>O=C(CCCc1ccncc1)N<mask_1:1>nc([C@H]2CCCCO2)nc1<mask_1:1> | 4 | 17 | 1 | Cc1c | 1 | O=C(CCCc1ccncc1)N1nc([C@H]2CCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | 1 |
<|startoftext|><L>O=C(CCCc1ccncc1)NCc1cnc([C@H]2CC<mask_1:6>nc1<mask_1:6> | 5 | 32 | 6 | CCO2) | 6 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | CCCO2) |
<|startoftext|><L>O=C(CCCc1ccncc1)NCc1cnc([C<mask_1:5>CCO2)nc1<mask_1:5> | 6 | 26 | 5 | @H]2CC | 5 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | @H]2C |
<|startoftext|><L>O=C(CCCc1ccncc1)NCc<mask_1:6>[C@H]2CCCCO2)nc1<mask_1:6> | 5 | 19 | 6 | 1cnc( | 6 | O=C(CCCc1ccncc1)NCc1ccc(O[C@H]2CCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | 1ccc(O |
<|startoftext|><L>O=C(CCCc1ccncc1)NCc1cnc([C@H<mask_1:2>CO2)nc1<mask_1:2> | 5 | 28 | 2 | ]2CCC | 2 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | ]2 |
<|startoftext|><L>O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCC<mask_1:6>nc1<mask_1:6> | 4 | 33 | 6 | CO2) | 6 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCN2CCO)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | N2CCO) |
<|startoftext|><L>O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCC<mask_1:3>O2)nc1<mask_1:3> | 1 | 33 | 3 | C | 3 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | CCC |
<|startoftext|><L>O=C(<mask_1:3>1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1<mask_1:3> | 4 | 4 | 3 | CCCc | 3 | O=C(CCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | CCc |
<|startoftext|><L>O=C(CCCc1ccncc1<mask_1:6>c1cnc([C@H]2CCCCO2)nc1<mask_1:6> | 3 | 15 | 6 | )NC | 6 | O=C(CCCc1ccncc1)N(O)Cc1cnc([C@H]2CCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | )N(O)C |
<|startoftext|><L>O=C(CCCc1ccncc1)NC<mask_1:6>([C@H]2CCCCO2)nc1<mask_1:6> | 5 | 18 | 6 | c1cnc | 6 | O=C(CCCc1ccncc1)NCCc1ccc([C@H]2CCCCO2)nc1 | O=C(CCCc1ccncc1)NCc1cnc([C@H]2CCCCO2)nc1 | Cc1ccc |
<|startoftext|><L>O=C(NC[C@<mask_1:6>cccs1)N1CCOCC1)c1cc2ccccc2cc1O<mask_1:6> | 5 | 9 | 6 | H](c1 | 6 | O=C(NC[C@@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | @H](c1 |
<|startoftext|><L>O=C(<mask_1:2>](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O<mask_1:2> | 6 | 4 | 2 | NC[C@H | 2 | O=C([S](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | [S |
<|startoftext|><L><mask_1:5>[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O<mask_1:5> | 6 | 0 | 5 | O=C(NC | 5 | O=C(N[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | O=C(N |
<|startoftext|><L>O=C(NC[C@H](c1cccs1)N1CCOC<mask_1:3>)c1cc2ccccc2cc1O<mask_1:3> | 2 | 26 | 3 | C1 | 3 | O=C(NC[C@H](c1cccs1)N1CCOCCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | CC1 |
<|startoftext|><L>O=C(NC[C@H](c1cccs1<mask_1:5>CC1)c1cc2ccccc2cc1O<mask_1:5> | 6 | 19 | 5 | )N1CCO | 5 | O=C(NC[C@H](c1cccs1)N1CCCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | )N1CC |
<|startoftext|><L>O=C(NC[C@H](c1cc<mask_1:4>s1)N1CCOCC1)c1cc2ccccc2cc1O<mask_1:4> | 1 | 16 | 4 | c | 4 | O=C(NC[C@H](c1ccc(F)s1)N1CCOCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | c(F) |
<|startoftext|><L>O=C(NC[C@H](c1cccs1)N1<mask_1:1>CC1)c1cc2ccccc2cc1O<mask_1:1> | 3 | 22 | 1 | CCO | 1 | O=C(NC[C@H](c1cccs1)N1CCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | C |
<|startoftext|><L>O=C(NC[C@H](c1cccs1)N1CCOCC1<mask_1:6>)c1cc2ccccc2cc1O<mask_1:6> | 0 | 28 | 6 | 6 | O=C(NC[C@H](c1cccs1)N1CCOCC1)NC(=O)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | )NC(=O |
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<|startoftext|><L>O=C(N<mask_1:2>](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O<mask_1:2> | 5 | 5 | 2 | C[C@H | 2 | O=C(N[C](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | [C |
<|startoftext|><L>O=C(NC[C@H](c1ccc<mask_1:6>N1CCOCC1)c1cc2ccccc2cc1O<mask_1:6> | 3 | 17 | 6 | s1) | 6 | O=C(NC[C@H](c1ccccc1Cl)N1CCOCC1)c1cc2ccccc2cc1O | O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc2ccccc2cc1O | cc1Cl) |
<|startoftext|><L>C[C@@H](NC(=O<mask_1:3>C=CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:3> | 4 | 13 | 3 | )C1C | 3 | C[C@@H](NC(=O)C1C=CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | )C1 |
<|startoftext|><L>C[C@@H](NC(=O)C<mask_1:2>CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:2> | 4 | 15 | 2 | 1CC= | 2 | C[C@@H](NC(=O)C1CCC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | 1C |
<|startoftext|><L>C[C<mask_1:5>(NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:5> | 4 | 3 | 5 | @@H] | 5 | C[C@](O)(NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | @](O) |
<|startoftext|><L>C[C@@H](NC(=O)C1<mask_1:2>1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:2> | 5 | 16 | 2 | CC=CC | 2 | C[C@@H](NC(=O)C1CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | CC |
<|startoftext|><L>C[C@@H](NC(=O)C<mask_1:6>CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:6> | 4 | 15 | 6 | 1CC= | 6 | C[C@@H](NC(=O)CN1CCCCCC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | N1CCCC |
<|startoftext|><L>C[C@@H](NC(=O)C<mask_1:4>C=CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:4> | 2 | 15 | 4 | 1C | 4 | C[C@@H](NC(=O)C1=CCC=CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | 1=CC |
<|startoftext|><L>C[C@@H](NC<mask_1:6>(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:6> | 0 | 10 | 6 | 6 | C[C@@H](NC(=O)NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | (=O)NC |
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<|startoftext|><L>C[C@@H](NC(=O)C1CC=CC1)[C@H]<mask_1:5>(Cl)cccc1Cl<mask_1:5> | 6 | 28 | 5 | (O)c1c | 5 | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | (O)c1 |
<|startoftext|><L>C[C@@H](N<mask_1:6>)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:6> | 4 | 9 | 6 | C(=O | 6 | C[C@@H](NCNC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | CNC(=O |
<|startoftext|><L>C[C@@H](<mask_1:2>O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl<mask_1:2> | 4 | 8 | 2 | NC(= | 2 | C[C@@H](N(O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | C[C@@H](NC(=O)C1CC=CC1)[C@H](O)c1c(Cl)cccc1Cl | N( |
<|startoftext|><L>Cc1cccc<mask_1:4>(=O)Nc2cc(Cl)ccc2F)c1<mask_1:4> | 2 | 7 | 4 | (C | 4 | Cc1cccc(CNC(=O)Nc2cc(Cl)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | (CNC |
<|startoftext|><L>Cc1cccc(C(=O)Nc2cc(Cl)<mask_1:2>ccc2F)c1<mask_1:2> | 0 | 22 | 2 | 2 | Cc1cccc(C(=O)Nc2cc(Cl)ccccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | cc |
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<|startoftext|><L>Cc1<mask_1:1>cc(C(=O)Nc2cc(Cl)ccc2F)c1<mask_1:1> | 2 | 3 | 1 | cc | 1 | Cc1scc(C(=O)Nc2cc(Cl)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | s |
<|startoftext|><L>Cc1cc<mask_1:1>C(=O)Nc2cc(Cl)ccc2F)c1<mask_1:1> | 3 | 5 | 1 | cc( | 1 | Cc1cc(C(=O)Nc2cc(Cl)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | ( |
<|startoftext|><L>Cc1cccc(C(=O)Nc2cc(Cl)<mask_1:4>cc2F)c1<mask_1:4> | 1 | 22 | 4 | c | 4 | Cc1cccc(C(=O)Nc2cc(Cl)c(N)cc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | c(N) |
<|startoftext|><L>Cc1cccc(C(=O)Nc2cc(Cl<mask_1:3>2F)c1<mask_1:3> | 4 | 21 | 3 | )ccc | 3 | Cc1cccc(C(=O)Nc2cc(Cl)sc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | )sc |
<|startoftext|><L>Cc1cccc(C(=O)Nc2cc(<mask_1:1>)ccc2F)c1<mask_1:1> | 2 | 19 | 1 | Cl | 1 | Cc1cccc(C(=O)Nc2cc(F)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | F |
<|startoftext|><L>Cc1cccc(C(=O<mask_1:2>Nc2cc(Cl)ccc2F)c1<mask_1:2> | 1 | 12 | 2 | ) | 2 | Cc1cccc(C(=O)NNc2cc(Cl)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | )N |
<|startoftext|><L>Cc1cccc(C(=O)N<mask_1:4>2cc(Cl)ccc2F)c1<mask_1:4> | 1 | 14 | 4 | c | 4 | Cc1cccc(C(=O)NCCOc2cc(Cl)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | CCOc |
<|startoftext|><L>Cc1cccc(C(=O)N<mask_1:3>2cc(Cl)ccc2F)c1<mask_1:3> | 1 | 14 | 3 | c | 3 | Cc1cccc(C(=O)NCCc2cc(Cl)ccc2F)c1 | Cc1cccc(C(=O)Nc2cc(Cl)ccc2F)c1 | CCc |
<|startoftext|><L>Cc1nn(CC(=O)Nc2ccc(F)cc2<mask_1:5>O)c2c1cnn2C(C)(C)C<mask_1:5> | 4 | 24 | 5 | )c(= | 5 | Cc1nn(CC(=O)Nc2ccc(F)cc2F)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | F)c(= |
<|startoftext|><L>Cc1nn(CC(=O)Nc2c<mask_1:4>c(F)cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:4> | 1 | 16 | 4 | c | 4 | Cc1nn(CC(=O)Nc2cc(F)c(F)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | c(F) |
<|startoftext|><L>Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn<mask_1:4>(C)(C)C<mask_1:4> | 2 | 37 | 4 | 2C | 4 | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2CCC(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | 2CCC |
<|startoftext|><L><mask_1:1>Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:1> | 0 | 0 | 1 | 1 | CCc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | C |
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<|startoftext|><L>Cc1nn(CC(=O)Nc2ccc<mask_1:5>cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:5> | 3 | 18 | 5 | (F) | 5 | Cc1nn(CC(=O)Nc2ccc(C#N)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | (C#N) |
<|startoftext|><L>C<mask_1:2>C(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:2> | 6 | 1 | 2 | c1nn(C | 2 | C1(C(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | 1( |
<|startoftext|><L>Cc1nn(CC(<mask_1:4>=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:4> | 0 | 9 | 4 | 4 | Cc1nn(CC(C)C(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | C)C( |
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<|startoftext|><L>Cc1nn<mask_1:2>(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:2> | 3 | 5 | 2 | (CC | 2 | Cc1nn(C(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | (C |
<|startoftext|><L>Cc1nn(CC<mask_1:5>(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C<mask_1:5> | 0 | 8 | 5 | 5 | Cc1nn(CCN(C)C(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | N(C)C |
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<|startoftext|><L>Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(<mask_1:4>C)(C)C<mask_1:4> | 0 | 40 | 4 | 4 | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)C(C)(C)C | Cc1nn(CC(=O)Nc2ccc(F)cc2)c(=O)c2c1cnn2C(C)(C)C | C)C( |
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<|startoftext|><L>CCCCNC(=O)[C@@H](<mask_1:6>)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1<mask_1:6> | 2 | 17 | 6 | CC | 6 | CCCCNC(=O)[C@@H](C)C(=O)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | C)C(=O |
<|startoftext|><L>CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)<mask_1:3>ccc1<mask_1:3> | 6 | 40 | 3 | CCc1cc | 3 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)c1sccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | c1s |
<|startoftext|><L>CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)C<mask_1:3>cccc1<mask_1:3> | 4 | 41 | 3 | Cc1c | 3 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)Cc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | c1c |
<|startoftext|><L>CCC<mask_1:2>(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1<mask_1:2> | 3 | 3 | 2 | CNC | 2 | CCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | NC |
<|startoftext|><L>CCCCNC(=O)[C@@H](CC)N(Cc1cc<mask_1:3>F)cc1)C(=O)CCc1ccccc1<mask_1:3> | 2 | 27 | 3 | c( | 3 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(CF)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | c(C |
<|startoftext|><L>CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)<mask_1:3>C(=O)CCc1ccccc1<mask_1:3> | 0 | 35 | 3 | 3 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C=CC(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | C=C |
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<|startoftext|><L>CCCCNC(=O)[C<mask_1:5>C)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1<mask_1:5> | 6 | 12 | 5 | @@H](C | 5 | CCCCNC(=O)[C@@H](C)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | @@H]( |
<|startoftext|><L>CCCCNC(=O)[C@@H](<mask_1:1>c1ccc(F)cc1)C(=O)CCc1ccccc1<mask_1:1> | 6 | 17 | 1 | CC)N(C | 1 | CCCCNC(=O)[C@@H](Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | C |
<|startoftext|><L>CCC<mask_1:2>NC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1<mask_1:2> | 1 | 3 | 2 | C | 2 | CCCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | CC |
<|startoftext|><L>CCCCNC(=O)[C@@H](CC)N(Cc1cc<mask_1:7>)cc1)C(=O)CCc1ccccc1<mask_1:7> | 3 | 27 | 7 | c(F | 7 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(C(C)C)cc1)C(=O)CCc1ccccc1 | CCCCNC(=O)[C@@H](CC)N(Cc1ccc(F)cc1)C(=O)CCc1ccccc1 | c(C(C)C |
<|startoftext|><L>CCC(=O)c1cccc(F)c1C(<mask_1:1>F)(F)F<mask_1:1> | 0 | 20 | 1 | 1 | CCC(=O)c1cccc(F)c1C(CF)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | C |
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<|startoftext|><L>CCC(=O)c1c<mask_1:1>c(F)c1C(F)(F)F<mask_1:1> | 2 | 10 | 1 | cc | 1 | CCC(=O)c1csc(F)c1C(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | s |
<|startoftext|><L>CCC(=O)c1cccc(F)c1C(F)(F<mask_1:2>F<mask_1:2> | 1 | 24 | 2 | ) | 2 | CCC(=O)c1cccc(F)c1C(F)(F)CF | CCC(=O)c1cccc(F)c1C(F)(F)F | )C |
<|startoftext|><L>CCC(=O)c1<mask_1:1>cc(F)c1C(F)(F)F<mask_1:1> | 2 | 9 | 1 | cc | 1 | CCC(=O)c1scc(F)c1C(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | s |
<|startoftext|><L>C<mask_1:2>CC(=O)c1cccc(F)c1C(F)(F)F<mask_1:2> | 0 | 1 | 2 | 2 | CCSCC(=O)c1cccc(F)c1C(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | CS |
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<|startoftext|><L>CCC(<mask_1:3>)c1cccc(F)c1C(F)(F)F<mask_1:3> | 2 | 4 | 3 | =O | 3 | CCC(C#N)c1cccc(F)c1C(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | C#N |
<|startoftext|><L>CCC(=O)c1cccc(F)c<mask_1:3>C(F)(F)F<mask_1:3> | 1 | 17 | 3 | 1 | 3 | CCC(=O)c1cccc(F)c1OCC(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | 1OC |
<|startoftext|><L>CCC<mask_1:2>)c1cccc(F)c1C(F)(F)F<mask_1:2> | 3 | 3 | 2 | (=O | 2 | CCC(C)c1cccc(F)c1C(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | (C |
<|startoftext|><L>CCC(=O)c1cccc(<mask_1:3>)c1C(F)(F)F<mask_1:3> | 1 | 14 | 3 | F | 3 | CCC(=O)c1cccc(C#N)c1C(F)(F)F | CCC(=O)c1cccc(F)c1C(F)(F)F | C#N |
<|startoftext|><L>CCC(=O)c1cccc(F)c1C(F)(<mask_1:3>F<mask_1:3> | 2 | 23 | 3 | F) | 3 | CCC(=O)c1cccc(F)c1C(F)(F)CF | CCC(=O)c1cccc(F)c1C(F)(F)F | F)C |
<|startoftext|><L><mask_1:5>cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C<mask_1:5> | 4 | 0 | 5 | COc1 | 5 | CCOc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | CCOc1 |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=<mask_1:6>N1[C@H](C)CCC[C@H]1C<mask_1:6> | 2 | 20 | 6 | O) | 6 | COc1cc(C=O)ccc1OCC(=O)NCCCN1[C@H](C)CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | O)NCCC |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=O)N1[C@H]<mask_1:4>CCC[C@H]1C<mask_1:4> | 3 | 29 | 4 | (C) | 4 | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | (C)C |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=O)N1[C@H](C<mask_1:5>CCC[C@H]1C<mask_1:5> | 1 | 31 | 5 | ) | 5 | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC=CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | )CCC= |
<|startoftext|><L>COc1cc(C=O)ccc1<mask_1:3>=O)N1[C@H](C)CCC[C@H]1C<mask_1:3> | 4 | 15 | 3 | OCC( | 3 | COc1cc(C=O)ccc1OC(=O)N1[C@H](C)CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | OC( |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=O<mask_1:6>@H](C)CCC[C@H]1C<mask_1:6> | 5 | 21 | 6 | )N1[C | 6 | COc1cc(C=O)ccc1OCC(=O)N1[C@@H](C)CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | )N1[C@ |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=O)N<mask_1:6>C@H](C)CCC[C@H]1C<mask_1:6> | 2 | 23 | 6 | 1[ | 6 | COc1cc(C=O)ccc1OCC(=O)NCCCN1[C@H](C)CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | CCCN1[ |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@<mask_1:4>C<mask_1:4> | 3 | 38 | 4 | H]1 | 4 | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | @H]1 |
<|startoftext|><L>COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)<mask_1:5>C[C@H]1C<mask_1:5> | 2 | 32 | 5 | CC | 5 | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)C(=O)C[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | C(=O) |
<|startoftext|><L>COc1cc(C=O)ccc1O<mask_1:2>C(=O)N1[C@H](C)CCC[C@H]1C<mask_1:2> | 1 | 16 | 2 | C | 2 | COc1cc(C=O)ccc1OCCC(=O)N1[C@H](C)CCC[C@H]1C | COc1cc(C=O)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C | CC |