smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=CC[N@H+]1CCC[C@]2(CC1)C[NH2+]Cc1ccccc1O2 ZINC000019015192 372147633 /nfs/dbraw/zinc/14/76/33/372147633.db2.gz BFVGXAHDYQXYDW-KRWDZBQOSA-N 2 1 272.392 2.579 40 30 CFEBMP C[NH+](C)C1CC2(C1)CC[N@@H+](Cc1ccc(F)c(C#N)c1)C2 ZINC000108525091 186220382 /nfs/dbraw/zinc/22/03/82/186220382.db2.gz VDGFSRDWMFSCNO-UHFFFAOYSA-N 2 1 287.382 2.613 40 30 CFEBMP C=CC[N@H+]1CCC[C@@]2(CC1)C[NH2+]Cc1ccccc1O2 ZINC000019015189 372147478 /nfs/dbraw/zinc/14/74/78/372147478.db2.gz BFVGXAHDYQXYDW-QGZVFWFLSA-N 2 1 272.392 2.579 40 30 CFEBMP