In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2011 | 20 | No |
Popular Name: 8-[(4S)-2-oxothiazolidine-4-carbonyl]-1,3,8-triazaspiro[4.5]decane-2,4-dione 8-[(4S)-2-oxothiazolidine-4-carb…
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) | -1.23 | -2.51 | -21.39 | 3 | 8 | 0 | 108 | 298.324 | 1 | ↓ |
Hi High (pH 8-9.5) | -1.05 | -5.16 | -48.34 | 2 | 8 | -1 | 114 | 297.316 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.