General Information of the Compound
| Compound ID |
CP0444430
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| Compound Name |
3-((4-(benzo[d][1,3]dioxol-5-yl)-5-(6-methylpyridin-2-yl)-1H-imidazol-2-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(CNc2cccc(c2)C(N)=O)[nH]c1-c1ccc2OCOc2c1
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| InChI |
InChI=1S/C24H21N5O3/c1-14-4-2-7-18(27-14)23-22(15-8-9-19-20(11-15)32-13-31-19)28-21(29-23)12-26-17-6-3-5-16(10-17)24(25)30/h2-11,26H,12-13H2,1H3,(H2,25,30)(H,28,29)
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| InChIKey |
KCLBSJRHQNKFOR-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