| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: 3-[(1S)-1-[[(1S)-1-(4-chlorophenyl)ethyl]amino]ethyl]benzonitrile 3-[(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) | 4.42 | 10.4 | -51.82 | 2 | 2 | 1 | 40 | 285.798 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.42 | 9.54 | -5.83 | 1 | 2 | 0 | 36 | 284.79 | 4 | ↓ |
