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-(3-pyridyl)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) | 4.03 | 10.4 | -17.67 | 5 | 9 | 0 | 127 | 455.522 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 10.48 | -40.4 | 6 | 9 | 1 | 128 | 456.53 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 10.37 | -41.46 | 6 | 9 | 1 | 128 | 456.53 | 9 | ↓ |