In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 23 | Yes |
Popular Name: 8-[(3-cyclohexyl-1H-pyrazol-4-yl)methyl]-2,8-diazaspiro[4.5]decan-3-one 8-[(3-cyclohexyl-1H-pyrazol-4-yl…
None
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 | 6.39 | -55.47 | 3 | 5 | 1 | 62 | 317.457 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.89 | 4.15 | -8.97 | 2 | 5 | 0 | 61 | 316.449 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.