In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 14 | No |
Popular Name: 5-(2-cyclohexylethyl)-2,3-dihydro-1,3,4-oxadiazole-2-thione 5-(2-cyclohexylethyl)-2,3-dihydr…
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CAS Number: 1152542-39-6
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) | 2.15 | 3.33 | -8.07 | 1 | 3 | 0 | 42 | 212.318 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.88 | 2.61 | -39.25 | 0 | 3 | -1 | 39 | 211.31 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |