smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H]1CC[C@H](C)P1CC[PH+]1[C@@H](C)CC[C@@H]1C ZINC000002572356 567848449 /nfs/dbraw/zinc/84/84/49/567848449.db2.gz IRCDUOCGSIGEAI-XUXIUFHCSA-N 1 3 258.326 5.092 50 0 CKAAHO C[C@@H]1CC[C@@H](C)P1CC[PH+]1[C@H](C)CC[C@H]1C ZINC000002572357 567848387 /nfs/dbraw/zinc/84/83/87/567848387.db2.gz IRCDUOCGSIGEAI-AAVRWANBSA-N 1 3 258.326 5.092 50 0 CKAAHO CC(C)(C)P1CCC[C@@H]1[C@H]1CCC[P@H+]1C(C)(C)C ZINC000071771914 567902216 /nfs/dbraw/zinc/90/22/16/567902216.db2.gz SJNUZTRUIDRSJK-JDPPGYRCSA-N 1 3 286.380 5.872 50 0 CKAAHO CC(C)(C)P1CCC[C@@H]1[C@H]1CCC[P@@H+]1C(C)(C)C ZINC000071771914 567902214 /nfs/dbraw/zinc/90/22/14/567902214.db2.gz SJNUZTRUIDRSJK-JDPPGYRCSA-N 1 3 286.380 5.872 50 0 CKAAHO CP(C[PH+](C(C)(C)C)C(C)(C)C)C(C)(C)C ZINC000071771982 567902049 /nfs/dbraw/zinc/90/20/49/567902049.db2.gz UHGZPEYSLJHZCA-UHFFFAOYSA-N 1 3 262.358 5.933 50 0 CKAAHO