smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)(C)CCBr 1664800 717089367 /nfs/dbraw/zinc/08/93/67/717089367.db2.gz VQHMRKMHWCMMTG-UHFFFAOYSA-N 1 0 167.070 1.088 50 50 in-vitro ADGARO C[N+](C)(C)CCCBr 1704463 717089569 /nfs/dbraw/zinc/08/95/69/717089569.db2.gz ZPRBOWQPJKXKDP-UHFFFAOYSA-N 1 0 181.097 1.478 50 50 in-vivo ADGARO C[N+](C)(C)CCCCl 39643406 717127206 /nfs/dbraw/zinc/12/72/06/717127206.db2.gz QTWPCBRXUJSXRP-UHFFFAOYSA-N 1 0 136.646 1.322 50 50 in-vitro ADGARO