smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)CCCc1cn(CCC[NH+](C)C)c2c1C(=O)c1ccncc1C2=O ZINC000071416596 221347746 /nfs/dbraw/zinc/34/77/46/221347746.db2.gz RIHCXPYNEQMJFD-UHFFFAOYSA-N 1 3 368.481 2.104 1 10 FECFHO Cn1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)NCCC[NH+](C)C)CN(C)[C@@H]1C2 ZINC000095581336 209082191 /nfs/dbraw/zinc/08/21/91/209082191.db2.gz ZURHOOYLDKXCGA-YVWKXTFCSA-N 1 3 368.525 2.206 1 10 FECFHO