In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2011 | 26 | Yes |
Popular Name: 4-[3-(4-phenylphenyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]butan-1-ol 4-[3-(4-phenylphenyl)-1,4,6,7-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) | 3.71 | 8.9 | -47.77 | 3 | 4 | 1 | 53 | 348.47 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.71 | 6.67 | -8.42 | 2 | 4 | 0 | 52 | 347.462 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.