| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 18 | Yes |
Popular Name: (1S,2R,4S)-4-phenyl-2-pyrrolidin-1-yl-cyclohexanamine (1S,2R,4S)-4-phenyl-2-pyrrolidin…
| 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) | 2.34 | 8.15 | -124.19 | 4 | 2 | 2 | 32 | 246.398 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.34 | 8.2 | -30.12 | 3 | 2 | 1 | 30 | 245.39 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.34 | 6.27 | -44.47 | 3 | 2 | 1 | 31 | 245.39 | 2 | ↓ |
