smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)CCc1cn(CC[NH+](C)C)c2c1C(=O)c1ccncc1C2=O ZINC000071341755 203093883 /nfs/dbraw/zinc/09/38/83/203093883.db2.gz SKULIXKKRSPGIL-UHFFFAOYSA-N 2 0 340.427 1.324 1 10 EDCFRP C[N+]1(C)CCN(/[N+](O)=N/Oc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000043071834 213557261 /nfs/dbraw/zinc/55/72/61/213557261.db2.gz XVPLIXKRBBGROX-LGMDPLHJSA-N 2 0 341.304 1.066 1 10 EDCFRP