| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 21 | Yes |
Popular Name: 2-bromo-4-[[[(1R)-1-(2-bromophenyl)ethyl]amino]methyl]-6-methoxy-phenol 2-bromo-4-[[[(1R)-1-(2-bromophen…
| 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) | 4.52 | 7.18 | -48.54 | 3 | 3 | 1 | 46 | 416.133 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.52 | 8.1 | -59.4 | 2 | 3 | 0 | 49 | 415.125 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.52 | 6.17 | -6.44 | 2 | 3 | 0 | 41 | 415.125 | 5 | ↓ |
