In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2011 | 25 | Yes |
Popular Name: 6-[(2S)-2-(2,2-dimethylpropyl)pyrrolidin-1-yl]sulfonyl-1,4-dihydroquinoxaline-2,3-dione 6-[(2S)-2-(2,2-dimethylpropyl)py…
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) | 1.39 | 3.31 | -15.41 | 2 | 7 | 0 | 103 | 365.455 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 1.18 | -51.01 | 1 | 7 | -1 | 106 | 364.447 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.