| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 19 | Yes |
Popular Name: (1R,2R,4S)-2-(azepan-1-yl)-4-(1,1-dimethylpropyl)cyclohexanamine (1R,2R,4S)-2-(azepan-1-yl)-4-(1,…
| 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) | 3.69 | 8.27 | -116.47 | 4 | 2 | 2 | 32 | 268.489 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | 7.94 | -29.81 | 3 | 2 | 1 | 30 | 267.481 | 3 | ↓ |
