| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 19 | Yes |
Popular Name: 2-chloro-4-[[[(1S)-1-(3-fluorophenyl)ethyl]amino]methyl]phenol 2-chloro-4-[[[(1S)-1-(3-fluoroph…
| 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) | 3.98 | 6.66 | -50.78 | 3 | 2 | 1 | 37 | 280.75 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 5.53 | -5.19 | 2 | 2 | 0 | 32 | 279.742 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 7.42 | -62.44 | 2 | 2 | 0 | 40 | 279.742 | 4 | ↓ |
