In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 4-[(1S)-1-hydroxy-2-[isopentyl(methyl)amino]ethyl]benzonitrile 4-[(1S)-1-hydroxy-2-[isopentyl(m…
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) | 2.56 | 7.23 | -46.4 | 2 | 3 | 1 | 48 | 247.362 | 6 | ↓ |