| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 9 | Yes |
Popular Name: 7-METHYL-1,4-DIAZEPAN-5-ONE 7-METHYL-1,4-DIAZEPAN-5-ONE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 90673-37-3 , [90673-37-3]
5H-1,4-Diazepin-5-one, hexahydro-7-methyl- (7CI)
| 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) | 0.89 | -0.09 | -48.02 | 3 | 3 | 1 | 46 | 129.183 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.89 | -1.31 | -7.32 | 2 | 3 | 0 | 41 | 128.175 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
