| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 21 | Yes |
Popular Name: 4-[(1S)-1-[[(1S)-1-(4-chlorophenyl)propyl]amino]ethyl]benzonitrile 4-[(1S)-1-[[(1S)-1-(4-chlorophen…
| 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) | 4.05 | 11.02 | -53.49 | 2 | 2 | 1 | 40 | 299.825 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 10.3 | -6.1 | 1 | 2 | 0 | 36 | 298.817 | 5 | ↓ |
