| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2008 | 19 | Yes |
Popular Name: 4-(2-hydroxyethyl)-1-[(4-hydroxyphenyl)methyl]-1,4-diazepan-5-one 4-(2-hydroxyethyl)-1-[(4-hydroxy…
None
| 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) | 0.11 | 2.06 | -48.51 | 3 | 5 | 1 | 65 | 265.333 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.11 | 0.04 | -9.83 | 2 | 5 | 0 | 64 | 264.325 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
