| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 15 | Yes |
Popular Name: 2-(1,4-diazepan-1-yl)benzonitrile 2-(1,4-diazepan-1-yl)benzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1020986-79-1 , 1258650-73-5
| 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) | 1.31 | 5.28 | -39.22 | 2 | 3 | 1 | 44 | 202.281 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 167 - 169 | Enamine Building Blocks |
| MP | 167...169 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
