In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2008 | 12 | Yes |
Popular Name: 2-Phenylisothiazol-3(2H)-one 2-Phenylisothiazol-3(2H)-one
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CAS Number: 21277-98-5
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) | 1.85 | 5.53 | -13.13 | 0 | 2 | 0 | 22 | 177.228 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.