General Information of the Compound
| Compound ID |
CP0465941
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| Compound Name |
3-((5-(2-(cyclopropylamino)pyrimidin-4-yl)-4-(4-fluorophenyl)-1H-imidazol-2-yl)methyl)benzonitrile
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| Structure |
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| Formula |
C24H19FN6
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| Molecular Weight |
410.456
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| Canonical SMILES |
Fc1ccc(cc1)-c1[nH]c(Cc2cccc(c2)C#N)nc1-c1ccnc(NC2CC2)n1
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| InChI |
InChI=1S/C24H19FN6/c25-18-6-4-17(5-7-18)22-23(20-10-11-27-24(29-20)28-19-8-9-19)31-21(30-22)13-15-2-1-3-16(12-15)14-26/h1-7,10-12,19H,8-9,13H2,(H,30,31)(H,27,28,29)
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| InChIKey |
ZHXAPDRXQTWSJO-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