| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 21 | Yes |
Popular Name: 4-bromo-2-[(1R)-1-[[(1S)-1-(2-chlorophenyl)ethyl]amino]propyl]phenol 4-bromo-2-[(1R)-1-[[(1S)-1-(2-ch…
| 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) | 4.97 | 8.68 | -38.5 | 3 | 2 | 1 | 37 | 369.71 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 7.94 | -7.33 | 2 | 2 | 0 | 32 | 368.702 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.97 | 9.47 | -39.21 | 2 | 2 | 0 | 40 | 368.702 | 5 | ↓ |
