| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 20 | Yes |
Popular Name: 2-[4-(3,5-dimethyl-1H-pyrazole-4-carbonyl)-1,4-diazepan-1-yl]acetamide 2-[4-(3,5-dimethyl-1H-pyrazole-4…
| 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) | -1.45 | 2.01 | -46.62 | 4 | 7 | 1 | 97 | 280.352 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.45 | 0.38 | -13.83 | 3 | 7 | 0 | 95 | 279.344 | 3 | ↓ |
