General Information of the Compound
Compound ID |
CP0375342
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Compound Name |
4-[[1-(1,3-benzodioxol-5-yl)-2-(6-methylpyridin-2-yl)imidazol-4-yl]methylamino]benzamide
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Structure |
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Formula |
C24H21N5O3
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Molecular Weight |
427.464
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Canonical SMILES |
Cc1cccc(n1)-c1nc(CNc2ccc(cc2)C(N)=O)cn1-c1ccc2OCOc2c1
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InChI |
InChI=1S/C24H21N5O3/c1-15-3-2-4-20(27-15)24-28-18(12-26-17-7-5-16(6-8-17)23(25)30)13-29(24)19-9-10-21-22(11-19)32-14-31-21/h2-11,13,26H,12,14H2,1H3,(H2,25,30)
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InChIKey |
WCYSDHAULCHXID-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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