| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 20 | Yes |
Popular Name: (3S)-3-[(2-prop-2-ynoxyphenyl)methylamino]azepan-2-one (3S)-3-[(2-prop-2-ynoxyphenyl)me…
| 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) | 1.67 | 5.92 | -36.33 | 3 | 4 | 1 | 55 | 273.356 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 5.48 | -9.09 | 2 | 4 | 0 | 50 | 272.348 | 5 | ↓ |
