In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 18 | Yes |
Popular Name: 2-cyclopropyl-1,1,3-trioxo-2,3-dihydro-1$l^{6},2-benzothiazole-6-carboxylic acid 2-cyclopropyl-1,1,3-trioxo-2,3-d…
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CAS Number: 1082558-21-1
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) | 0.73 | 2.22 | -46.29 | 0 | 6 | -1 | 95 | 266.254 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 283 - 285 | Enamine Building Blocks |
MP | 283...285 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |