smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCC[C@@H](CCC)CCC(C)C ZINC000070454257 290750037 /nfs/dbraw/zinc/75/00/37/290750037.db2.gz CABCROIGBFQLHZ-CYBMUJFWSA-N 0 0 184.367 5.029 1 0 biogenic,in-vitro AKAFRN CCCCCC[C@@H](C)C[C@@H](C)CCC ZINC000070454522 290750071 /nfs/dbraw/zinc/75/00/71/290750071.db2.gz FNUQJWPIADDMRS-UONOGXRCSA-N 0 0 198.394 5.419 1 0 biogenic,in-vitro AKAFRN CCCCCC[C@@H](C)C(C)(C)CC ZINC000085972376 571792518 /nfs/dbraw/zinc/79/25/18/571792518.db2.gz AVICXEDVKYYQCS-GFCCVEGCSA-N 0 0 184.367 5.029 1 0 endogenous,in-man AKAFRN CCCCCC[C@H](C)C(C)(C)CC ZINC000085972378 571792262 /nfs/dbraw/zinc/79/22/62/571792262.db2.gz AVICXEDVKYYQCS-LBPRGKRZSA-N 0 0 184.367 5.029 1 0 endogenous,in-man AKAFRN CCC[C@@H](C)CCCC[C@@H](C)CC ZINC000090416355 167028698 /nfs/dbraw/zinc/02/86/98/167028698.db2.gz WOGVWUCXENBLIV-QWHCGFSZSA-N 0 0 184.367 5.029 1 0 in-vitro AKAFRN CCC[C@H](C)CCCC[C@@H](C)CC ZINC000090416356 167064140 /nfs/dbraw/zinc/06/41/40/167064140.db2.gz WOGVWUCXENBLIV-STQMWFEESA-N 0 0 184.367 5.029 1 0 in-vitro AKAFRN CCC[C@@H](C)CCCC[C@H](C)CC ZINC000090416357 167029455 /nfs/dbraw/zinc/02/94/55/167029455.db2.gz WOGVWUCXENBLIV-CHWSQXEVSA-N 0 0 184.367 5.029 1 0 in-vitro AKAFRN CCC[C@H](C)CCCC[C@H](C)CC ZINC000090416358 167065101 /nfs/dbraw/zinc/06/51/01/167065101.db2.gz WOGVWUCXENBLIV-OLZOCXBDSA-N 0 0 184.367 5.029 1 0 in-vitro AKAFRN CC[C@H](C)CCCCCCC(C)C ZINC000096334077 167596305 /nfs/dbraw/zinc/59/63/05/167596305.db2.gz XDLHYYXVEXQVGL-ZDUSSCGKSA-N 0 0 184.367 5.029 1 0 AKAFRN CCCC[C@@H](C)CC[C@@H](C)CCC ZINC000096334079 166915661 /nfs/dbraw/zinc/91/56/61/166915661.db2.gz IEVWHTVOIZEXCC-QWHCGFSZSA-N 0 0 184.367 5.029 1 0 AKAFRN CCCCCC[C@@H](CC)CCCC ZINC000096334228 166855059 /nfs/dbraw/zinc/85/50/59/166855059.db2.gz MKHPXJRMKJYYON-ZDUSSCGKSA-N 0 0 184.367 5.173 1 0 AKAFRN CCCCC[C@H](C)[C@H](C)CCCC ZINC000096334294 166875285 /nfs/dbraw/zinc/87/52/85/166875285.db2.gz YAQUQAWUOHDAOP-OLZOCXBDSA-N 0 0 184.367 5.029 1 0 AKAFRN