| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 33 | Yes |
Popular Name: 3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]-N-(3-morpholinopropyl)benzamide 3-[[2-(3-methylanilino)pyrimidin…
| 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) | 4.18 | 10.08 | -14.04 | 3 | 8 | 0 | 91 | 446.555 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.18 | 12.36 | -50.99 | 4 | 8 | 1 | 93 | 447.563 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.18 | 11.97 | -88.47 | 5 | 8 | 2 | 94 | 448.571 | 9 | ↓ |
