| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 20 | Yes |
Popular Name: 2-bromo-4-[[2-(3-methylphenoxy)ethylamino]methyl]phenol 2-bromo-4-[[2-(3-methylphenoxy)e…
| 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) | 4.12 | 6.42 | -48.23 | 3 | 3 | 1 | 46 | 337.237 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 7.17 | -62.15 | 2 | 3 | 0 | 49 | 336.229 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 5.07 | -5.99 | 2 | 3 | 0 | 41 | 336.229 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
