In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 19 | Yes |
Popular Name: 6-(thiophene-2-carbonyl)-1,4-dihydroquinoxaline-2,3-dione 6-(thiophene-2-carbonyl)-1,4-dih…
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) | 1.07 | 3.74 | -14.98 | 2 | 5 | 0 | 83 | 272.285 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 1.56 | -52.82 | 1 | 5 | -1 | 86 | 271.277 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.