| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 32 | Yes |
Popular Name: N-(3-imidazol-1-ylpropyl)-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide N-(3-imidazol-1-ylpropyl)-3-[[2-…
| 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) | 3.99 | 14.7 | -45.5 | 4 | 8 | 1 | 98 | 428.52 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 14.18 | -17.54 | 3 | 8 | 0 | 97 | 427.512 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.99 | 14.31 | -82.01 | 5 | 8 | 2 | 99 | 429.528 | 9 | ↓ |
