| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2009 | 34 | No |
Popular Name: 4-(5-benzyl-2,6-dimethyl-pyrimidin-4-yl)-N-(4-nitrophenyl)-1,4-diazepane-1-carboxamide 4-(5-benzyl-2,6-dimethyl-pyrimid…
| 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) | 4.12 | 12.96 | -15.68 | 1 | 9 | 0 | 107 | 460.538 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 13.35 | -42.03 | 2 | 9 | 1 | 108 | 461.546 | 5 | ↓ |
