In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 24 | Yes |
Popular Name: (4-methyl-1,4-diazepan-1-yl)-[2-(4-methylphenoxy)-3-pyridyl]methanone (4-methyl-1,4-diazepan-1-yl)-[2-…
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) | 2.32 | 8.93 | -45.72 | 1 | 5 | 1 | 47 | 326.42 | 3 | ↓ |