General Information of the Compound
| Compound ID |
CP0486162
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| Compound Name |
3-(dimethylamino)-N-[3-(naphthalen-1-ylamino)-1H-indazol-5-yl]cyclohexane-1-carboxamide
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| Structure |
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| Formula |
C26H29N5O
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| Molecular Weight |
427.552
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| Canonical SMILES |
CN(C)C1CCCC(C1)C(=O)Nc1ccc2[nH]nc(Nc3cccc4ccccc34)c2c1
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| InChI |
InChI=1S/C26H29N5O/c1-31(2)20-10-5-9-18(15-20)26(32)27-19-13-14-24-22(16-19)25(30-29-24)28-23-12-6-8-17-7-3-4-11-21(17)23/h3-4,6-8,11-14,16,18,20H,5,9-10,15H2,1-2H3,(H,27,32)(H2,28,29,30)
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| InChIKey |
SYRXVDLZFPQOOZ-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