In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2011 | 22 | No |
Popular Name: 3-phenethyl-9-thioxo-3,8,10-triazaspiro[5.5]undecane-7,11-dione 3-phenethyl-9-thioxo-3,8,10-tria…
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) | 1.62 | 5.49 | -44.25 | 2 | 5 | 0 | 69 | 317.414 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 3.27 | -33.15 | 1 | 5 | -1 | 68 | 316.406 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.