In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 17th, 2011 | 24 | Yes |
Popular Name: (2R)-3-[3-(1-naphthyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propane-1,2-diol (2R)-3-[3-(1-naphthyl)-1,4,6,7-t…
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) | 1.89 | 4.1 | -50.31 | 4 | 5 | 1 | 74 | 324.404 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 1.62 | -12.13 | 3 | 5 | 0 | 72 | 323.396 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.