General Information of the Compound
| Compound ID |
CP0723794
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| Compound Name |
(R)-7-(3,4-dichlorophenyl)-6-(1-(2-ethoxyethyl)-1H-imidazol-2-yl)-5-methyl-2-(trifluoromethyl)-4,7-dihydropyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C21H20Cl2F3N5O
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| Molecular Weight |
486.325
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| Canonical SMILES |
CCOCCn1ccnc1C1=C(C)Nc2cc(C(F)(F)F)nn2[C@@H]1c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C21H20Cl2F3N5O/c1-3-32-9-8-30-7-6-27-20(30)18-12(2)28-17-11-16(21(24,25)26)29-31(17)19(18)13-4-5-14(22)15(23)10-13/h4-7,10-11,19,28H,3,8-9H2,1-2H3/t19-/m1/s1
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| InChIKey |
GNSQFAFLGCQTOG-LJQANCHMSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound