In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2009 | 12 | Yes |
Popular Name: Isothiazolo[5,4-c]pyridin-3(2H)-one 1,1-dioxide Isothiazolo[5,4-c]pyridin-3(2H)-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 142141-07-9 , [142141-07-9]
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) | -0.80 | -4.53 | -41.28 | 0 | 5 | -1 | 82 | 183.168 | 0 | ↓ |
Lo Low (pH 4.5-6) | -0.80 | -4.05 | -56.09 | 1 | 5 | 0 | 84 | 184.176 | 0 | ↓ |
No pre-computed analogs available. Try a structural similarity search.