smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1nc(N2CC[NH+](C)CC2)cc(Nc2ccccc2)[nH+]1 ZINC000216848208 262341407 /nfs/dbraw/zinc/34/14/07/262341407.db2.gz NDSNAKUVUVIYCP-UHFFFAOYSA-N 2 2 283.379 2.280 40 70 CEIBLP