In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 11 | Yes |
Popular Name: 4-Benzothiazolol, 6-methyl- (9CI) 4-Benzothiazolol, 6-methyl- (9CI)
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CAS Number: 97716-51-3
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) | 2.50 | 1.73 | -8.34 | 1 | 2 | 0 | 33 | 165.217 | 0 | ↓ |
Hi High (pH 8-9.5) | 2.50 | 2.5 | -50.48 | 0 | 2 | -1 | 36 | 164.209 | 0 | ↓ |