In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 19 | Yes |
Popular Name: (2S)-3-[[(1S,2R)-2-amino-1-(4-chlorophenyl)propyl]-ethyl-amino]-2-methyl-propanenitrile (2S)-3-[[(1S,2R)-2-amino-1-(4-ch…
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) | 2.72 | 5.63 | -51.39 | 3 | 3 | 1 | 55 | 280.823 | 6 | ↓ |