| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-N-[(4-chlorophenyl)methyl]-1-isopropyl-pyrrolidin-3-amine (3S)-N-[(4-chlorophenyl)methyl]-…
| 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) | 3.00 | 6.08 | -44.22 | 2 | 2 | 1 | 20 | 253.797 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 7.41 | -33.39 | 2 | 2 | 1 | 16 | 253.797 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 4.94 | -2.04 | 1 | 2 | 0 | 15 | 252.789 | 4 | ↓ |
