In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 18 | Yes |
Popular Name: 2-[[(1R,2S)-2-amino-1-(4-chlorophenyl)propyl]-(2-hydroxyethyl)amino]ethanol 2-[[(1R,2S)-2-amino-1-(4-chlorop…
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) | 0.54 | -2.04 | -49.45 | 5 | 4 | 1 | 71 | 273.784 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 0.67 | -111.02 | 6 | 4 | 2 | 73 | 274.792 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.54 | 0.38 | -34.09 | 5 | 4 | 1 | 71 | 273.784 | 7 | ↓ |