| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2011 | 20 | Yes |
Popular Name: 1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzodiazepine 1-[(5-chloro-1,3-dimethyl-pyrazo…
| 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) | 2.21 | 6.87 | -46.17 | 2 | 4 | 1 | 38 | 291.806 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.21 | 5.62 | -6.62 | 1 | 4 | 0 | 33 | 290.798 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
