smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(/C=C/c1cccs1)NC(=S)NNC(=O)Cn1nnc(N2CCOCC2)n1 3138363 CKXZRVZGZAZWSZ-ONEGZZNKSA-N 422.496 -0.694 50 30 HBGC NCCCC[C@@H](N)C(=O)Oc1ccc(C[C@@H](N)C(=O)OC(=O)[C@H]2CCCN2)cc1 223716628 UCSGZMOLDYNARP-BRWVUGGUSA-N 406.483 -0.260 50 30 HBGC O=c1cc(CCl)c2cc(F)c(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(F)c2o1 34295946 ATTAHAWLQLRXSU-DSERSLQPSA-N 408.737 -0.011 50 30 HBGC CS(=O)(=O)c1ccc([C@H](O)[C@H](COC(=O)CN)NC(=O)C(Cl)Cl)cc1 59868021 AMGKHLVPQHMHGQ-JQWIXIFHSA-N 413.279 -0.086 50 30 HBGC C[C@@H](C(=O)NNS(=O)(=O)c1ccc(Cl)cc1)n1nnc(N2CCOCC2)n1 1044886 JDMBUVCIVUJFRW-JTQLQIEISA-N 415.863 -0.266 50 30 HBGC CS(=O)(=O)c1ccc([C@H](O)[C@@H](COC(=O)CN)NC(=O)C(Cl)Cl)cc1 59868018 AMGKHLVPQHMHGQ-PWSUYJOCSA-N 413.279 -0.086 50 30 HBGC C[C@H](C(=O)NNS(=O)(=O)c1ccc(Cl)cc1)n1nnc(N2CCOCC2)n1 1044887 JDMBUVCIVUJFRW-SNVBAGLBSA-N 415.863 -0.266 50 30 HBGC