| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 25th, 2008 | 10 | Yes |
Popular Name: octahydro-1H-pyrrolo[1,2-a][1,4]diazepine octahydro-1H-pyrrolo[1,2-a][1,4]…
Find On: PubMed — Wikipedia — Google
CAS Number: 109324-83-6
| 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) | 0.30 | 1.73 | -35.57 | 2 | 2 | 1 | 20 | 141.238 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.30 | 2.79 | -27.13 | 2 | 2 | 1 | 16 | 141.238 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.30 | 4.02 | -102.01 | 3 | 2 | 2 | 21 | 142.246 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
