In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 17 | Yes |
Popular Name: 2-[[(1R)-2-amino-1-(4-fluorophenyl)ethyl]-isopropyl-amino]ethanol 2-[[(1R)-2-amino-1-(4-fluorophen…
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) | 0.93 | 2.27 | -131.16 | 5 | 3 | 2 | 52 | 242.338 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 1.73 | -46.23 | 4 | 3 | 1 | 51 | 241.33 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 1.89 | -33.01 | 4 | 3 | 1 | 51 | 241.33 | 6 | ↓ |