In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | Yes |
Popular Name: N-benzyl-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide N-benzyl-3-[[2-(3-methylanilino)…
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) | 5.43 | 13.84 | -11.93 | 3 | 6 | 0 | 79 | 409.493 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.43 | 13.46 | -39.96 | 4 | 6 | 1 | 80 | 410.501 | 7 | ↓ |