| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 26 | Yes |
Popular Name: 4-[[isopropyl-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]amino]methyl]benzonitrile 4-[[isopropyl-[(7-methyl-4-oxo-p…
| 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) | 3.32 | 10.54 | -42.07 | 1 | 5 | 1 | 63 | 347.442 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 12.12 | -53.38 | 1 | 5 | 1 | 63 | 347.442 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 10.09 | -15.53 | 0 | 5 | 0 | 61 | 346.434 | 5 | ↓ |
