In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 27 | Yes |
Popular Name: 2-[[3-(3,4-difluorophenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]methyl]benzoic 2-[[3-(3,4-difluorophenyl)-1,4,6…
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) | 3.18 | 10.98 | -45.1 | 2 | 5 | 0 | 73 | 369.371 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 9.22 | -49.47 | 1 | 5 | -1 | 72 | 368.363 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.