smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC1(C)CCC[C@H]2COc3cc(O)c4c(=O)cc(-c5ccc(O)c(O)c5)oc4c3C[C@H]21 ZINC000033834133 291273809 /nfs/dbraw/zinc/27/38/09/291273809.db2.gz NKZVXBLXJXFAAZ-GOEBONIOSA-N 0 0 422.477 4.954 1 10 biogenic,in-vitro HJCFRN COc1ccc(N2CCN(C(=O)c3cc4c(s3)-c3c(C)cccc3OC4)CC2)cc1 ZINC000006802773 132317539 /nfs/dbraw/zinc/31/75/39/132317539.db2.gz LXANSROSNDPADL-UHFFFAOYSA-N 0 0 420.534 4.587 1 10 HJCFRN Cc1c(Br)cc(-c2ccc(S(C)(=O)=O)cc2)n1-c1ccc(F)cc1 ZINC000003814511 581092459 /nfs/dbraw/zinc/09/24/59/581092459.db2.gz YAGVGZRCFDSMDV-UHFFFAOYSA-N 0 0 408.292 4.758 1 10 HJCFRN