General Information of the Compound
| Compound ID |
CP0096108
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| Compound Name |
1-(4-(3-amino-7-(2-methoxyethoxy)-1H-indazol-4-yl)phenyl)-3-m-tolylurea
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| Structure |
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| Formula |
C24H25N5O3
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| Molecular Weight |
431.496
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| Canonical SMILES |
COCCOc1ccc(-c2ccc(NC(=O)Nc3cccc(C)c3)cc2)c2c(N)n[nH]c12
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| InChI |
InChI=1S/C24H25N5O3/c1-15-4-3-5-18(14-15)27-24(30)26-17-8-6-16(7-9-17)19-10-11-20(32-13-12-31-2)22-21(19)23(25)29-28-22/h3-11,14H,12-13H2,1-2H3,(H3,25,28,29)(H2,26,27,30)
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| InChIKey |
CPMMIVUAUOMULB-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