In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 18 | Yes |
Popular Name: 3-cyclohexyl-6-(trifluoromethyl)-2,4(1H,3H)-pyrimidinedione 3-cyclohexyl-6-(trifluoromethyl)…
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CAS Number: 26676-01-7
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) | 2.89 | 3.48 | -32.72 | 0 | 4 | -1 | 58 | 261.223 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.43 | 5.21 | -5.41 | 1 | 4 | 0 | 55 | 262.231 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 198 - 200 | KeyOrganics |
No pre-computed analogs available. Try a structural similarity search.