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)Cc1ccc(Nc2c3ccccc3[nH+]c3cc(N)ccc32)cc1 ZINC000029307841 212661146 /nfs/dbraw/zinc/66/11/46/212661146.db2.gz VBZYGKUXQKKJFM-UHFFFAOYSA-N 2 0 342.446 4.775 1 10 EJCFRP C[N+](C)(C)Cc1cccc(/N=N/c2cccc(C[N+](C)(C)C)c2)c1 ZINC000006068163 560205029 /nfs/dbraw/zinc/20/50/29/560205029.db2.gz KCOSVQHBILQVFB-QURGRASLSA-N 2 0 326.488 4.514 3 10 in-vitro EJCFRP