In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 24 | No |
Popular Name: 8-[4-(dimethylamino)-3-fluoro-benzoyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[4-(dimethylamino)-3-fluoro-be…
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) | 0.18 | 2.76 | -15.88 | 2 | 7 | 0 | 82 | 334.351 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.36 | 0.14 | -46.09 | 1 | 7 | -1 | 88 | 333.343 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.