smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Oc1cc2c(cc1O)[C@@H](c1ccc(Br)cc1)[NH2+]CC2 ZINC000003727774 181044720 /nfs/dbraw/zinc/04/47/20/181044720.db2.gz KUMLYMARUJDDOO-OAHLLOKOSA-N 1 2 320.186 3.095 1 10 DGCFLO Cc1[nH]c(-c2ccc3c(c2)NC(=O)CO3)c(-c2ccccc2)[nH+]1 ZINC000082150723 192361513 /nfs/dbraw/zinc/36/15/13/192361513.db2.gz MESMVBGSIYUYGI-UHFFFAOYSA-N 1 2 305.337 3.383 1 10 DGCFLO Cc1[nH]c(-c2ccccc2)c(-c2ccc3c(c2)NC(=O)CO3)[nH+]1 ZINC000082150723 192361516 /nfs/dbraw/zinc/36/15/16/192361516.db2.gz MESMVBGSIYUYGI-UHFFFAOYSA-N 1 2 305.337 3.383 1 10 DGCFLO