In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 12 | Yes |
Popular Name: 2(3H)-Benzothiazolone, 3,6-dimethyl- (9CI) 2(3H)-Benzothiazolone, 3,6-dimet…
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CAS Number: 100445-18-9
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) | 2.31 | 5.15 | -7.35 | 0 | 2 | 0 | 22 | 179.244 | 0 | ↓ |