| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 9th, 2011 | 24 | Yes |
Popular Name: 1-[4-[(4-hydroxy-2-quinolyl)methyl]-1,4-diazepan-1-yl]-2-methoxy-ethanone 1-[4-[(4-hydroxy-2-quinolyl)meth…
| 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) | 0.38 | 6.5 | -20.85 | 1 | 6 | 0 | 66 | 329.4 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.38 | 8.36 | -64.44 | 2 | 6 | 1 | 67 | 330.408 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
