smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1cc(CCc2cc[n+](CCC[N+](C)(C)C)cc2)c2ccccc21 ZINC000001566902 452668474 /nfs/dbraw/zinc/66/84/74/452668474.db2.gz ADCSYVXJAPHBFY-UHFFFAOYSA-N 2 0 337.511 3.347 40 5 EGBBRP CC[N+](C)(C)CCCOc1ccc(OCCC[N+](C)(C)CC)cc1 ZINC000001848388 452679864 /nfs/dbraw/zinc/67/98/64/452679864.db2.gz WRTZPAAUPMYHAJ-UHFFFAOYSA-N 2 0 338.536 3.417 40 5 EGBBRP CC[N+](C)(CC)CCOCCCCCOCC[N+](C)(CC)CC ZINC000005469334 452876514 /nfs/dbraw/zinc/87/65/14/452876514.db2.gz KIKTXERRZHTRQM-UHFFFAOYSA-N 2 0 332.573 3.163 40 5 EGBBRP