In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 13 | Yes |
Popular Name: 1H-1,5-benzodiazepine-2,4(3H,5H)-dione 1H-1,5-benzodiazepine-2,4(3H,5H)…
Find On: PubMed — Wikipedia — Google
CAS Number: 49799-48-6
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) | 0.38 | 1.11 | -10.71 | 2 | 4 | 0 | 58 | 176.175 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 383 - 385 | Enamine Building Blocks |
MP | 383...385 | Enamine Building Blocks |
melting_point | 390 | KeyOrganics |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.