In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 34 | Yes |
Popular Name: 3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]-N-[2-(1-piperidyl)ethyl]benzamide 3-[[2-amino-6-(3-methoxyanilino)…
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) | 4.41 | 11.56 | -48.58 | 6 | 9 | 1 | 119 | 462.578 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.41 | 11.65 | -80.29 | 7 | 9 | 2 | 120 | 463.586 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.41 | 11.53 | -83.45 | 7 | 9 | 2 | 120 | 463.586 | 9 | ↓ |