General Information of the Compound
| Compound ID |
CP0478300
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| Compound Name |
3-amino-N-[3-[(4-methoxyphenyl)methylamino]-1H-indazol-5-yl]cyclohexane-1-carboxamide
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| Structure |
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| Formula |
C22H27N5O2
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| Molecular Weight |
393.491
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| Canonical SMILES |
COc1ccc(CNc2n[nH]c3ccc(NC(=O)C4CCCC(N)C4)cc23)cc1
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| InChI |
InChI=1S/C22H27N5O2/c1-29-18-8-5-14(6-9-18)13-24-21-19-12-17(7-10-20(19)26-27-21)25-22(28)15-3-2-4-16(23)11-15/h5-10,12,15-16H,2-4,11,13,23H2,1H3,(H,25,28)(H2,24,26,27)
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| InChIKey |
DCYKGIAYETYOGO-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