General Information of the Compound
| Compound ID |
CP0871876
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| Compound Name |
(E)-2-(4-Chloro-3-(trifluoromethyl)phenyl)-N-(3-(2-(pyridin-2-yl)vinyl)-1H-indazol-6-yl)acetamide
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| Structure |
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| Formula |
C23H16ClF3N4O
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| Molecular Weight |
456.855
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| Canonical SMILES |
O=C(Cc1ccc(Cl)c(C(F)(F)F)c1)Nc1ccc2c(/C=C/c3ccccn3)n[nH]c2c1
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| InChI |
InChI=1S/C23H16ClF3N4O/c24-19-8-4-14(11-18(19)23(25,26)27)12-22(32)29-16-5-7-17-20(30-31-21(17)13-16)9-6-15-3-1-2-10-28-15/h1-11,13H,12H2,(H,29,32)(H,30,31)/b9-6+
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| InChIKey |
GABYDLKRDNUFQA-RMKNXTFCSA-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