| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 21 | Yes |
Popular Name: 2-(3,5-dimethylpyrazol-1-yl)-1-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)ethanone 2-(3,5-dimethylpyrazol-1-yl)-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) | 1.25 | 6.83 | -53.21 | 2 | 5 | 1 | 55 | 285.371 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 5.58 | -12.22 | 1 | 5 | 0 | 50 | 284.363 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
