smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)=CCC/C(C)=C/COc1cc([O-])c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O ZINC000005707026 291283900 /nfs/dbraw/zinc/28/39/00/291283900.db2.gz JVTPNJZXKNTJEF-OVCLIPMQSA-N -1 3 406.478 5.253 1 10 biogenic,in-vitro HKCFHM CC(C)=CCc1c2c(c([O-])c3c1O[C@H](c1ccc(O)c(O)c1)CC3=O)C=CC(C)(C)O2 ZINC000032297054 291286731 /nfs/dbraw/zinc/28/67/31/291286731.db2.gz MUADCOGGQPLCBH-FQEVSTJZSA-N -1 3 422.477 5.203 1 10 biogenic,in-vitro HKCFHM CC(C)=CCC/C(C)=C/Cc1c2oc3c(c2cc(O)c1[O-])COc1cc(O)ccc1-3 ZINC000036401323 291284311 /nfs/dbraw/zinc/28/43/11/291284311.db2.gz DDKLBJZRUKOEJA-VIZOYTHASA-N -1 3 406.478 6.344 1 10 biogenic,in-vitro HKCFHM