General Information of the Compound
| Compound ID |
CP0221111
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| Compound Name |
1-(4-(3-amino-1-(2-methoxyethoxy)-1H-indazol-4-yl)phenyl)-3-(3-chlorophenyl)urea
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| Structure |
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| Formula |
C23H22ClN5O3
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| Molecular Weight |
451.914
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| Canonical SMILES |
COCCOn1nc(N)c2c(cccc12)-c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
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| InChI |
InChI=1S/C23H22ClN5O3/c1-31-12-13-32-29-20-7-3-6-19(21(20)22(25)28-29)15-8-10-17(11-9-15)26-23(30)27-18-5-2-4-16(24)14-18/h2-11,14H,12-13H2,1H3,(H2,25,28)(H2,26,27,30)
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| InChIKey |
XZTHAYPHBFXDAT-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