| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 21 | Yes |
Popular Name: (2,4-difluorophenyl)-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)methanone (2,4-difluorophenyl)-(2,3,4,5-te…
| 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) | 2.70 | 7.39 | -50.05 | 2 | 3 | 1 | 37 | 289.305 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.70 | 6.12 | -8.74 | 1 | 3 | 0 | 32 | 288.297 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
