smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCC(=[NH2+])[C@](CC)(c1ccccc1)[NH+](C)C ZINC000001686785 188274284 /nfs/dbraw/zinc/27/42/84/188274284.db2.gz QOLTUJLLBNSSLN-INIZCTEOSA-N 2 2 246.398 4.063 40 0 BIABLP CCCCC(=[NH2+])[C@@](CC)(c1ccccc1)[NH+](C)C ZINC000031637610 343222334 /nfs/dbraw/zinc/22/23/34/343222334.db2.gz QOLTUJLLBNSSLN-MRXNPFEDSA-N 2 2 246.398 4.063 40 0 BIABLP