| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2008 | 30 | Yes |
Popular Name: (4-cyclohexyl-1,4-diazepan-1-yl)-[6-(methyl-(3-pyridylmethyl)amino)-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) | 2.34 | 0.21 | -104.89 | 2 | 6 | 2 | 55 | 409.578 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.34 | 0.32 | -171.12 | 3 | 6 | 3 | 56 | 410.586 | 5 | ↓ |
