In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 21 | No |
Popular Name: 8-[3-(triazol-1-yl)propanoyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[3-(triazol-1-yl)propanoyl]-1,…
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) | -1.45 | -0.38 | -16.67 | 2 | 9 | 0 | 109 | 292.299 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.26 | -3.02 | -47.77 | 1 | 9 | -1 | 116 | 291.291 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.