In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 25 | Yes |
Popular Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[6-(2-hydroxyethylamino)-3-pyridyl]methanone (4-cyclohexyl-1,4-diazepan-1-yl)…
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) | 1.30 | 5.77 | -42.72 | 3 | 6 | 1 | 70 | 347.483 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.