In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2011 | 23 | No |
Popular Name: 8-[[(4R)-3-cyclohexyl-4H-pyrazol-4-yl]methyl]-2,8-diazaspiro[4.5]decan-3-one 8-[[(4R)-3-cyclohexyl-4H-pyrazol…
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) | 2.35 | 4.52 | -15.21 | 1 | 5 | 0 | 57 | 316.449 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 6.66 | -69.49 | 2 | 5 | 1 | 58 | 317.457 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.