In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 23 | Yes |
Popular Name: 3,6-diamino-5-cyano-4-methyl-N-phenyl-thieno[2,3-b]pyridine-2-carboxamide 3,6-diamino-5-cyano-4-methyl-N-p…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.43 | 4.02 | -9.14 | 5 | 6 | 0 | 118 | 323.381 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 4.46 | -39.15 | 6 | 6 | 1 | 119 | 324.389 | 2 | ↓ |