General Information of the Compound
| Compound ID |
CP0522411
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| Compound Name |
3-((4-(2-(cyclopropylamino)pyrimidin-4-yl)-5-(4-fluorophenyl)-1H-imidazol-1-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)-c1c(ncn1Cc1cccc(c1)C#N)-c1ccnc(NC2CC2)n1
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| InChI |
InChI=1S/C24H19FN6/c25-19-6-4-18(5-7-19)23-22(21-10-11-27-24(30-21)29-20-8-9-20)28-15-31(23)14-17-3-1-2-16(12-17)13-26/h1-7,10-12,15,20H,8-9,14H2,(H,27,29,30)
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| InChIKey |
WSGLIOCKVSXDGD-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