| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 20 | Yes |
Popular Name: 5-(2,3,4,5-tetrahydro-1,4-benzodiazepine-1-carbonyl)pyran-2-one 5-(2,3,4,5-tetrahydro-1,4-benzod…
| 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) | 1.14 | 6.73 | -55.01 | 2 | 5 | 1 | 67 | 271.296 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.14 | 5.45 | -10.36 | 1 | 5 | 0 | 63 | 270.288 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
