smiles
stringlengths 11
172
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41
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int64 8
77
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B5419563E07BFD32_144AD9D78ACC6A81_6038_UN
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O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C(C)CC3=CC=C(C=C3)C)=O
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D2CF21638BE5BA0F_99CE45854A825395_6038_UN
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3724F1E474019AD8_6F45813912D1667B_6038_DP
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FF449BF1064390F6_651320E3DA6ADD25_6038_UN
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ED3A556BE5632D74_DFB6EC56C93D00CB_6038_UN
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9D79BF7DC2353DEF_15F2D4D23224A5D4_6038_UN
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528B9A7C8D34CD86_EE757DCE6E38500B_6038_DP
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433D194D2D90E79D_75579B007F7951D3_6038_UN
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C8A0349C6624CDC3_CF445D2C1B71A186_6038_UN
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A828E028A0E8E875_4334DF050160BB3F_6038_UN
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D161E8FC40BF9E88_8A86F684CD294B1C_6038_UN
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00BA349207741B6F_10AA859A0F792D44_6038_UN
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C86F7C6CB574B305_3426817F1AEF584A_6038_UN
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30DE6B85A20A903E_E5E0FE6EAB9039D5_6038_UN
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CDF8570578F3C0BB_C7E86EC61593AAFC_6038_UN
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060B2AD197A58544_AFE82D421D28F3C9_6038_UN
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524716B05ED48AD3_64D03C333520B44A_6038_UN
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D4A072FAC62CD64A_785EE6F02D71A994_6038_UN
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634856A96255E2CB_7CD0E494BA0D97B4_6038_UN
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5911128F423E45BB_CC9E1170ED441F4B_6038_UN
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07EE01EE778C2706_6FB0C762ABB8A3AA_6038_UN
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0F095AA3D51D3AF6_F3DE0B036CEBF558_6038_UN
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46B95E161E49EFF2_F86CF1B5EBA0B3D3_6038_UN
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3EFCF662ECF86B80_A600EE6BCEB541D0_6038_UN
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494786F4C34C6E41_7BC3B36E4526693A_6038_UN
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D99AFBDDFA53208E_8BEBD44CC4253DF9_6038_UN
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28A29DB9297B1202_D2F6A6085BEE21E6_6038_UN
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575BF64675BA5EFA_74740DE8AA4FCCDC_6038_DP
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788FD125720D7532_EDC4B4A6E8CEF6DF_6038_UN
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DB918F7CB245654A_8BE28DA533CEF856_6038_UN
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5BEFD73C9D146E01_0D2CF240246F1612_6038_UN
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7E4A8B9831337A34_03AC3BBEF59B4D32_6038_UN
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F995E2310625B042_B87C082446FD667F_6038_DP
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4F476EE7799F5D81_FE007EA36C713192_6038_UN
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DBDD6C3702D6F272_673B0537995B51D5_6038_UN
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6769567CA5A9C5DA_36BEEF7BB95CEF30_6038_UN
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CE38CAC8A4CBB1FA_A9CEDD18484CF471_6038_UN
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81DF84D3FE3B0F50_BDC92A812A95C9C6_6038_UN
| 32
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=N[NH]C(=N3)N)=O
|
37C7902CE60A5C4E_D663696F79556C0C_6038_UN
| 24
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CC3=CC(=C(C=C3)Cl)Cl
|
DE647AE5573B2566_E874558838D38503_6038_UN
| 27
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=C(CC)C=C3)=O
|
6EDD5B239EC4CF62_A6190CC5ED746439_6038_UN
| 26
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC(=CC(=C3)[N](=O)=O)C(OC)=O)=O
|
8A3FB0E25EC8163E_9799622A9AF1533D_6038_UN
| 31
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=C(C(C)C)C=C3)=O
|
F0D9C94F49DBE023_7DA41888B10453FD_6038_UN
| 27
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=C(C(C3=CC=C(C)C=C3)=O)C=CC=C4)=O
|
31F79CBE460BCFA6_CB4442D34575BD29_6038_UN
| 33
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=C(C(=C(C)[NH]3)C(C)=O)C)=O
|
D2A1F923B22FDAC4_05EB14698CC1A92B_6038_UN
| 28
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3CCC(C(N(C)C)=O)CC3)=O
|
7EF0E9D6FFE19976_C171CFB44176F290_6038_UN
| 29
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C4=CN=C(C3=C(OC)C=CC=C3)[NH]4)=O
|
AE4EE7C5CD2B816D_A7C3186BE8B9B313_6038_UN
| 31
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C3=CC4=C(C=C3)[NH]C=N4
|
884D81ADC51456DB_D192D32425CBAD6D_6038_UN
| 27
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)C4C3=C(C=CC=C3)OC5=C4C=CC=C5
|
D94119AEB8944AD7_6819397A117F823D_6038_UN
| 32
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CC3=C[NH]C4=C3C=CC=C4
|
77B97ED50717EA1D_F44D71AC244EB7C4_6038_UN
| 28
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=CC(=C3OC)OC)=O
|
88A3861997906729_DCB93D1184CDDF45_6038_UN
| 28
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(=O)CCCC3=C[NH]C4=C3C=CC=C4
|
2025DDDFE092AEE7_5A4E43E1351D4F6C_6038_UN
| 30
|
O([C@@H]1CCCC[C@H]1C2=CC(=C(C(=C2)F)F)F)C(C3=CC=C(OC)C=C3)=O
|
451D869EF8C6C2B3_32381CA446875FA1_6038_UN
| 26
|
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