In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2007 | 18 | Yes |
Popular Name: 2-(1,3-benzothiazol-2-ylmethyl)-2-ethylbutanoic acid 2-(1,3-benzothiazol-2-ylmethyl)-…
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CAS Number: 923716-18-1
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) | 3.36 | 0.01 | -48.79 | 0 | 3 | -1 | 53 | 262.354 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 143 - 145 | Enamine Building Blocks |
MP | 143...145 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |