In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 29 | Yes |
Popular Name: 3,6-diamino-5-cyano-4-(3-pyridyl)-N-(3-pyridylmethyl)thieno[2,3-b]pyridine-2-carboxamide 3,6-diamino-5-cyano-4-(3-pyridyl…
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) | 1.17 | 3.48 | -10.65 | 5 | 8 | 0 | 144 | 401.455 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.17 | 3.94 | -41.89 | 6 | 8 | 1 | 145 | 402.463 | 4 | ↓ |