smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Oc1ccc2ccccc2c1N=Nc1ccccn1 ZINC000100021845 183285091 /nfs/dbraw/zinc/28/50/91/183285091.db2.gz LLYOXZQVOKALCD-ISLYRVAYSA-N 0 1 249.273 4.356 50 10 BICAMN Oc1c(N=Nc2ccccn2)ccc2ccccc21 ZINC000100056197 183253382 /nfs/dbraw/zinc/25/33/82/183253382.db2.gz DKWJRBBUVAQOAC-ISLYRVAYSA-N 0 1 249.273 4.356 50 10 BICAMN Oc1ccc2ccccc2c1N=Nc1ccccn1 ZINC000242548449 183285120 /nfs/dbraw/zinc/28/51/20/183285120.db2.gz LLYOXZQVOKALCD-UHFFFAOYSA-N 0 1 249.273 4.356 50 10 BICAMN