In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 32 | Yes |
Popular Name: 3-[[6-(N,3-dimethylanilino)pyrimidin-4-yl]amino]-N-(4-pyridylmethyl)benzamide 3-[[6-(N,3-dimethylanilino)pyrim…
None
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) | 3.97 | 11.96 | -12.97 | 2 | 7 | 0 | 83 | 424.508 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.97 | 12.42 | -46.85 | 3 | 7 | 1 | 84 | 425.516 | 7 | ↓ |