| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 18 | Yes |
Popular Name: (3R)-3-[(1,3,5-trimethylpyrazol-4-yl)methylamino]azepan-2-one (3R)-3-[(1,3,5-trimethylpyrazol-…
| 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) | 0.32 | 3.73 | -45.28 | 3 | 5 | 1 | 64 | 251.354 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.32 | 3.47 | -10.76 | 2 | 5 | 0 | 59 | 250.346 | 3 | ↓ |
