| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 17 | Yes |
Popular Name: 2-[[(2-hydroxyphenyl)methylamino]methyl]phenol 2-[[(2-hydroxyphenyl)methylamino…
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CAS Number: 4481-51-0
| 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) | 2.78 | 2.74 | -40.31 | 4 | 3 | 1 | 57 | 230.287 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 3.5 | -33.2 | 3 | 3 | 0 | 60 | 229.279 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 1.33 | -6.32 | 3 | 3 | 0 | 52 | 229.279 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| mp | 162 | MolMall (formerly Molecular Diversity Preservation International) |
