| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 20 | Yes |
Popular Name: 2-chloro-4-[[[(1R)-1-(3,4-difluorophenyl)ethyl]amino]methyl]phenol 2-chloro-4-[[[(1R)-1-(3,4-difluo…
| 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) | 4.10 | 6.69 | -57.58 | 3 | 2 | 1 | 37 | 298.74 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.10 | 5.58 | -8.16 | 2 | 2 | 0 | 32 | 297.732 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.10 | 7.46 | -68.38 | 2 | 2 | 0 | 40 | 297.732 | 4 | ↓ |
