smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+]1(CCOC[C@@H]2CCC[N@+]3(C)CCCC[C@H]23)CCCCC1 ZINC000247694061 432246411 /nfs/dbraw/zinc/24/64/11/432246411.db2.gz YEBJFOUHZMECGW-ZVDOUQERSA-N 2 0 310.526 3.043 50 5 biogenic,in-vitro DGBARP C[N+]1(CCOC[C@@H]2CCC[N@@+]3(C)CCCC[C@H]23)CCCCC1 ZINC000247694057 228626982 /nfs/dbraw/zinc/62/69/82/228626982.db2.gz YEBJFOUHZMECGW-QKNQBKEWSA-N 2 0 310.526 3.043 50 5 biogenic,in-vitro DGBARP Cn1c2ccccc2[n+]2c(C[N+]3(C)CCCCC3)csc12 ZINC000000495445 180807481 /nfs/dbraw/zinc/80/74/81/180807481.db2.gz SKUVAMFWJGBXCZ-UHFFFAOYSA-N 2 0 301.459 3.109 50 5 DGBARP