General Information of the Compound
| Compound ID |
CP0073246
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| Compound Name |
3-amino-N-[3-(2-methoxyanilino)-1H-indazol-5-yl]cyclohexane-1-carboxamide
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| Structure |
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| Formula |
C21H25N5O2
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| Molecular Weight |
379.464
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| Canonical SMILES |
COc1ccccc1Nc1n[nH]c2ccc(NC(=O)C3CCCC(N)C3)cc12
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| InChI |
InChI=1S/C21H25N5O2/c1-28-19-8-3-2-7-18(19)24-20-16-12-15(9-10-17(16)25-26-20)23-21(27)13-5-4-6-14(22)11-13/h2-3,7-10,12-14H,4-6,11,22H2,1H3,(H,23,27)(H2,24,25,26)
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| InChIKey |
HIDWMKJBUOIBEK-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