| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 13 | Yes |
Popular Name: 2-phenyl-[1,4]diazepane 2-phenyl-[1,4]diazepane
Find On: PubMed — Wikipedia — Google
CAS Number: 105627-85-8
| 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) | 1.25 | 3.1 | -42.02 | 3 | 2 | 1 | 29 | 177.271 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 2.94 | -38.8 | 3 | 2 | 1 | 29 | 177.271 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP1000936A1 | IBM Patent Data |
