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]1C[C@H](/C=[NH+]/Cc2ccccc2)[C@H](C)C[N@H+]1C ZINC000004785683 176279288 /nfs/dbraw/zinc/27/92/88/176279288.db2.gz HVZOFNAOZVRNQQ-XSSJVDGRSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[C@H](/C=[NH+]/Cc2ccccc2)[C@H](C)C[N@@H+]1C ZINC000004785683 176279287 /nfs/dbraw/zinc/27/92/87/176279287.db2.gz HVZOFNAOZVRNQQ-XSSJVDGRSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@@H]1/C=[NH+]/Cc1ccccc1 ZINC000004785684 176279226 /nfs/dbraw/zinc/27/92/26/176279226.db2.gz HVZOFNAOZVRNQQ-VUUUPPBXSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@@H]1/C=[NH+]/Cc1ccccc1 ZINC000004785684 176279225 /nfs/dbraw/zinc/27/92/25/176279225.db2.gz HVZOFNAOZVRNQQ-VUUUPPBXSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[C@@H](/C=[NH+]/Cc2ccccc2)[C@H](C)C[N@H+]1C ZINC000004785685 176278305 /nfs/dbraw/zinc/27/83/05/176278305.db2.gz HVZOFNAOZVRNQQ-FEBBGVTHSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[C@@H](/C=[NH+]/Cc2ccccc2)[C@H](C)C[N@@H+]1C ZINC000004785685 176278304 /nfs/dbraw/zinc/27/83/04/176278304.db2.gz HVZOFNAOZVRNQQ-FEBBGVTHSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[N@@H+](C)[C@@H](C)C[C@H]1/C=[NH+]/Cc1ccccc1 ZINC000004785686 176279002 /nfs/dbraw/zinc/27/90/02/176279002.db2.gz HVZOFNAOZVRNQQ-KVSZQYDPSA-N 2 1 244.382 3.234 50 30 BGEAMP C[C@@H]1C[N@H+](C)[C@@H](C)C[C@H]1/C=[NH+]/Cc1ccccc1 ZINC000004785686 176279000 /nfs/dbraw/zinc/27/90/00/176279000.db2.gz HVZOFNAOZVRNQQ-KVSZQYDPSA-N 2 1 244.382 3.234 50 30 BGEAMP