smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name N#Cc1c2c(cnc1N1CC[C@@H]3[C@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C1)C[NH2+]CCC2 ZINC001164751280 720810013 /nfs/dbraw/zinc/81/00/13/720810013.db2.gz XZQFLJBXZMKLGV-KKLQWCBXSA-N 2 1 432.576 1.960 20 30 IDEDMP N#Cc1c2c(cnc1N1CC[C@@H]3[C@@H](C[C@H](Cn4cncn4)[N@H+]3CC3CC3)C1)C[NH2+]CCC2 ZINC001164751279 720809945 /nfs/dbraw/zinc/80/99/45/720809945.db2.gz XZQFLJBXZMKLGV-JXHRLWIKSA-N 2 1 432.576 1.960 20 30 IDEDMP N#Cc1c2c(cnc1N1CC[C@@H]3[C@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C1)C[NH2+]CCC2 ZINC001164751281 720809847 /nfs/dbraw/zinc/80/98/47/720809847.db2.gz XZQFLJBXZMKLGV-QMHWCDLVSA-N 2 1 432.576 1.960 20 30 IDEDMP N#Cc1c2c(cnc1N1CC[C@@H]3[C@@H](C[C@@H](Cn4cncn4)[N@H+]3CC3CC3)C1)C[NH2+]CCC2 ZINC001164751278 720809722 /nfs/dbraw/zinc/80/97/22/720809722.db2.gz XZQFLJBXZMKLGV-GREBRCKQSA-N 2 1 432.576 1.960 20 30 IDEDMP