smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name c1ccc2c(c1)cccc2C1=CCN(C2CC2)CC1 ZINC000013605857 188280240 /nfs/dbraw/zinc/28/02/40/188280240.db2.gz CUJCOCXYGQUTBV-UHFFFAOYSA-N 0 3 249.357 4.091 1 0 BIAFHN CN1[C@H]2C=C(c3cccc4ccccc43)C[C@@H]1CC2 ZINC000040380260 173206301 /nfs/dbraw/zinc/20/63/01/173206301.db2.gz HYJFJJLDSPHUBO-CVEARBPZSA-N 0 3 249.357 4.090 1 0 BIAFHN CCC(=O)CC/C=C/C=C\C1=NC(C)=CC=CC1 ZINC000085886056 168198239 /nfs/dbraw/zinc/19/82/39/168198239.db2.gz WOIOXNFWBXFNFJ-QTJNYWJXSA-N 0 3 243.350 4.163 1 0 endogenous,in-man BIAFHN CCC(=O)CC/C=C/C=C/C1=NC(C)=CC=CC1 ZINC000143670361 168198192 /nfs/dbraw/zinc/19/81/92/168198192.db2.gz WOIOXNFWBXFNFJ-LJIKRCSCSA-N 0 3 243.350 4.163 1 0 BIAFHN