General Information of the Compound
| Compound ID |
CP0945977
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| Compound Name |
7-(3,4-dichlorophenyl)-6-(6-fluoro-1-methyl-1H-benzo[d]imidazol-2-yl)-5-methyl-4,7-dihydropyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C21H16Cl2FN5
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| Molecular Weight |
428.298
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| Canonical SMILES |
CC1=C(c2nc3ccc(F)cc3n2C)C(c2ccc(Cl)c(Cl)c2)n2nccc2N1
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| InChI |
InChI=1S/C21H16Cl2FN5/c1-11-19(21-27-16-6-4-13(24)10-17(16)28(21)2)20(29-18(26-11)7-8-25-29)12-3-5-14(22)15(23)9-12/h3-10,20,26H,1-2H3
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| InChIKey |
DOWMXECLUTUSBD-UHFFFAOYSA-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