| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2009 | 15 | Yes |
Popular Name: [5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methanamine [5-(trifluoromethyl)-1,3-benzoth…
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CAS Number: 224957-21-5
| 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) | 2.16 | 3.02 | -49.44 | 3 | 2 | 1 | 41 | 233.238 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 2.62 | -5.73 | 2 | 2 | 0 | 39 | 232.23 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
