| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 20 | Yes |
Popular Name: 4-bromo-2-[(1S)-1-[[(1R)-2-(diethylamino)-1-methyl-ethyl]amino]propyl]phenol 4-bromo-2-[(1S)-1-[[(1R)-2-(diet…
| 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) | 3.49 | 4.71 | -33.15 | 3 | 3 | 1 | 40 | 344.317 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.49 | 5.5 | -31.86 | 2 | 3 | 0 | 43 | 343.309 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 6.52 | -29.65 | 3 | 3 | 1 | 37 | 344.317 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.49 | 7.91 | -105.96 | 4 | 3 | 2 | 41 | 345.325 | 8 | ↓ |
