In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 16 | Yes |
Popular Name: 4-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,3-thiazol-2-one 4-[3-(trifluoromethyl)phenyl]-2,…
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CAS Number: 1095163-09-9
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) | 2.86 | 5.01 | -7.39 | 1 | 2 | 0 | 33 | 245.225 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.32 | 3.02 | -45.96 | 0 | 2 | -1 | 36 | 244.217 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 182 - 184 | Enamine Building Blocks |
MP | 182...184 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |