smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](Sc1ccncc1)c1ccccc1Cl ZINC000159957603 323055490 /nfs/dbraw/zinc/05/54/90/323055490.db2.gz SFMRVFSDYRYTDT-JTQLQIEISA-N 0 0 249.766 4.588 20 70 BJIDRN C[C@@H](Sc1ccncc1)c1ccccc1Cl ZINC000159957746 323055654 /nfs/dbraw/zinc/05/56/54/323055654.db2.gz SFMRVFSDYRYTDT-SNVBAGLBSA-N 0 0 249.766 4.588 20 70 BJIDRN C[C@H](Sc1ccncc1)c1cccc(Cl)c1 ZINC000159997955 323057259 /nfs/dbraw/zinc/05/72/59/323057259.db2.gz RCDGFRDMPAGRGV-JTQLQIEISA-N 0 0 249.766 4.588 20 70 BJIDRN C[C@@H](Sc1ccncc1)c1cccc(Cl)c1 ZINC000159998097 323057195 /nfs/dbraw/zinc/05/71/95/323057195.db2.gz RCDGFRDMPAGRGV-SNVBAGLBSA-N 0 0 249.766 4.588 20 70 BJIDRN