In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: 4-[(1R)-1-[(3-chloro-4-fluoro-phenyl)methylamino]ethyl]phenol 4-[(1R)-1-[(3-chloro-4-fluoro-ph…
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) | 3.75 | 6.57 | -52.69 | 3 | 2 | 1 | 37 | 280.75 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.75 | 5.46 | -7.15 | 2 | 2 | 0 | 32 | 279.742 | 4 | ↓ |