| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2009 | 14 | Yes |
Popular Name: 2(3H)-Benzothiazolone, 6-ethoxy-4-methyl- (9CI) 2(3H)-Benzothiazolone, 6-ethoxy-…
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CAS Number: 99161-62-3
2(3H)-Benzothiazolone, 6-ethoxy-4-methyl-; 6-Ethoxy-4-methyl-benzothiazol-2(3H)-one; LS-40929
| 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) | 2.60 | 3.66 | -5.92 | 1 | 3 | 0 | 42 | 209.27 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 1.74 | -41.76 | 0 | 3 | -1 | 45 | 208.262 | 2 | ↓ |
