| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 3-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]propan-1-amine 3-[4-[(3,5-dimethyl-1H-pyrazol-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) | -0.76 | -0.17 | -52.05 | 4 | 7 | 1 | 97 | 316.451 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.76 | 1.68 | -120.73 | 5 | 7 | 2 | 98 | 317.459 | 5 | ↓ |
