smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](CCCCCC[N@@H+](C)CC#Cc1ccccc1)Cc1ccccc1 ZINC000002299086 564003822 /nfs/dbraw/zinc/00/38/22/564003822.db2.gz KQFXCUWXXAASQI-UHFFFAOYSA-N 2 0 348.534 4.662 50 30 EJEARP C=CC[N+](CC)(CC)Cc1ccc(C[N+](CC)(CC)CC=C)cc1 ZINC000001571397 564074700 /nfs/dbraw/zinc/07/47/00/564074700.db2.gz ZKANZKIDVGLYTH-UHFFFAOYSA-N 2 0 330.560 4.772 50 30 EJEARP