In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 6th, 2010 | 20 | Yes |
Popular Name: 3-[[(1R,2S)-2-amino-1-(4-chlorophenyl)butyl]-isopropyl-amino]propan-1-ol 3-[[(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) | 2.66 | 2.89 | -45.16 | 4 | 3 | 1 | 51 | 299.866 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 4.08 | -36.03 | 4 | 3 | 1 | 51 | 299.866 | 8 | ↓ |