In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 20 | Yes |
Popular Name: 2-[[(1R,2S)-2-amino-1-(4-chlorophenyl)propyl]-cyclopentyl-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) | 2.58 | 4.53 | -110.97 | 5 | 3 | 2 | 52 | 298.858 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 3.05 | -46.4 | 4 | 3 | 1 | 51 | 297.85 | 6 | ↓ |