| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 18 | Yes |
Popular Name: (3S)-3-[(3,4-dimethylphenyl)methylamino]azepan-2-one (3S)-3-[(3,4-dimethylphenyl)meth…
| 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) | 2.32 | 6.24 | -41.51 | 3 | 3 | 1 | 46 | 247.362 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 5.89 | -7.37 | 2 | 3 | 0 | 41 | 246.354 | 3 | ↓ |
