smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)CCNC(=O)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@@H+](C3CCCC3)C[C@H]12 ZINC000035870417 569063906 /nfs/dbraw/zinc/06/39/06/569063906.db2.gz PNZJPEYUGYZNND-PZJWPPBQSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@H+](C3CCCC3)C[C@H]12 ZINC000035870417 569063907 /nfs/dbraw/zinc/06/39/07/569063907.db2.gz PNZJPEYUGYZNND-PZJWPPBQSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@@H+](C3CCCC3)C[C@H]12 ZINC000035870416 569063965 /nfs/dbraw/zinc/06/39/65/569063965.db2.gz PNZJPEYUGYZNND-TZIWHRDSSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@H+](C3CCCC3)C[C@H]12 ZINC000035870416 569063966 /nfs/dbraw/zinc/06/39/66/569063966.db2.gz PNZJPEYUGYZNND-TZIWHRDSSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@@H+](C3CCCC3)C[C@@H]12 ZINC000169681306 569127383 /nfs/dbraw/zinc/12/73/83/569127383.db2.gz PNZJPEYUGYZNND-FPOVZHCZSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@H+](C3CCCC3)C[C@@H]12 ZINC000169681306 569127384 /nfs/dbraw/zinc/12/73/84/569127384.db2.gz PNZJPEYUGYZNND-FPOVZHCZSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@@H+](C3CCCC3)C[C@@H]12 ZINC000169681305 569127387 /nfs/dbraw/zinc/12/73/87/569127387.db2.gz PNZJPEYUGYZNND-CTNGQTDRSA-N 1 3 415.538 1.878 50 5 HDBAHO CN(C)CCNC(=O)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CC[N@H+](C3CCCC3)C[C@@H]12 ZINC000169681305 569127388 /nfs/dbraw/zinc/12/73/88/569127388.db2.gz PNZJPEYUGYZNND-CTNGQTDRSA-N 1 3 415.538 1.878 50 5 HDBAHO