| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 33 | Yes |
Popular Name: N-methyl-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]-N-[2-(2-pyridyl)ethyl]benzamide N-methyl-3-[[2-(3-methylanilino)…
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) | 4.44 | 14.62 | -14.25 | 2 | 7 | 0 | 83 | 438.535 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.44 | 14.54 | -77.53 | 4 | 7 | 2 | 86 | 440.551 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.44 | 14.19 | -43.42 | 3 | 7 | 1 | 84 | 439.543 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.44 | 14.97 | -39.46 | 3 | 7 | 1 | 84 | 439.543 | 8 | ↓ |
