| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 2nd, 2012 | 13 | Yes |
Popular Name: 7,8-difluoro-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine 7,8-difluoro-2,3,4,5-tetrahydro-…
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CAS Number: 1354953-55-1
| 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) | 1.97 | 3.27 | -40.23 | 3 | 2 | 1 | 29 | 185.197 | 0 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 2.9 | -3.24 | 2 | 2 | 0 | 24 | 184.189 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.
