In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 15 | Yes |
Popular Name: 2(3H)-Benzothiazolone, 6-(1-oxobutyl)- (9CI) 2(3H)-Benzothiazolone, 6-(1-oxob…
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CAS Number: 133044-37-8
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) | 2.75 | -0.76 | -11.22 | 1 | 3 | 0 | 49 | 221.281 | 3 | ↓ |