In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 19 | No |
Popular Name: 2-[(1-methylpyrazol-4-yl)methyl]-2,4,8-triazaspiro[4.5]decane-1,3-dione 2-[(1-methylpyrazol-4-yl)methyl]…
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) | -1.15 | 1.99 | -55.81 | 3 | 7 | 1 | 84 | 264.309 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.15 | 0.67 | -9.83 | 2 | 7 | 0 | 79 | 263.301 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.