| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 15 | Yes |
Popular Name: 4-(1,4-diazepan-1-yl)benzonitrile 4-(1,4-diazepan-1-yl)benzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1192191-40-4 , 303134-11-4
| 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) | 1.36 | 4.93 | -46.13 | 2 | 3 | 1 | 44 | 202.281 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 249 - 251 | Enamine Building Blocks |
| MP | 249...251 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
