| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 12 | Yes |
Popular Name: 2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine 2-methyl-2,3,4,5-tetrahydro-1H-1…
Find On: PubMed — Wikipedia — Google
CAS Number: 40358-34-7
| 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) | 2.73 | 3.76 | -29.45 | 3 | 2 | 1 | 29 | 163.244 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 3.46 | -2.16 | 2 | 2 | 0 | 24 | 162.236 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| MP | 96 - 98 | Enamine Building Blocks |
| MP | 96...98 | Enamine Building Blocks |
