In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | Yes |
Popular Name: N-(1,3-dioxolan-2-ylmethyl)-N-methyl-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide N-(1,3-dioxolan-2-ylmethyl)-N-me…
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) | 3.61 | 11.74 | -14.12 | 2 | 8 | 0 | 89 | 419.485 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.61 | 11.33 | -43.74 | 3 | 8 | 1 | 90 | 420.493 | 7 | ↓ |