In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 20 | Yes |
Popular Name: 5-benzyl-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylic 5-benzyl-4,6,7,8-tetrahydropyraz…
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) | 1.77 | 8.66 | -83.35 | 1 | 5 | 0 | 62 | 271.32 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.77 | 6.59 | -60 | 0 | 5 | -1 | 61 | 270.312 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.