smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NS(=O)(=O)c1nnc([N-]S(=O)(=O)c2cccc3cccnc32)s1 ZINC000003923941 204117015 /nfs/dbraw/zinc/11/70/15/204117015.db2.gz FZHGBFVLVKBLAD-UHFFFAOYSA-N -1 0 371.425 0.535 40 0 FCABRM CC(C)[C@H](NC(=O)[C@H]1O[C@H]2OC(C)(C)O[C@@H]2[C@H]2OC(C)(C)O[C@@H]21)C(=O)[O-] ZINC000004264717 204130347 /nfs/dbraw/zinc/13/03/47/204130347.db2.gz VBVNAGGXPWGYAJ-RKHMABHUSA-N -1 0 373.402 0.608 40 0 FCABRM Cc1cc(=O)n(-c2ccc(S(=O)(=O)NC(=N)N)cc2)c(C)c1C(=O)[O-] ZINC000005462938 204210701 /nfs/dbraw/zinc/21/07/01/204210701.db2.gz PXEZVWVUSOFOHS-UHFFFAOYSA-N -1 0 364.383 0.324 40 0 FCABRM CO[C@@H]1O[C@@H]2COC(C)(C)O[C@H]2[C@@H]1[N-]S(=O)(=O)Cc1ccccc1 ZINC000004897577 204173461 /nfs/dbraw/zinc/17/34/61/204173461.db2.gz IZZAWLWAMFDOBV-LXTVHRRPSA-N -1 0 357.428 0.997 40 0 FCABRM CSCC[C@@H](NC(=O)[C@H](CO)NC(=O)OCc1ccccc1)C(=O)[O-] ZINC000005159074 204196235 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