| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 17 | Yes |
Popular Name: 5-CHLORO-2-(1,4-DIAZEPAN-1-YL)BENZO[D]OXAZOLE 5-CHLORO-2-(1,4-DIAZEPAN-1-YL)BE…
Find On: PubMed — Wikipedia — Google
CAS Number: 914299-55-1
| 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) | 2.18 | 4.63 | -47.55 | 2 | 4 | 1 | 46 | 252.725 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 3.28 | -6.93 | 1 | 4 | 0 | 41 | 251.717 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.
