General Information of the Compound
| Compound ID |
CP0869512
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| Compound Name |
(E)-N-(4-Chloro-3-(trifluoromethyl)phenyl)-N-(3-(2-(pyridin-2-yl)vinyl)-1H-indazol-6-yl)cyclopropane-1,1-dicarboxamide
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| Structure |
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| Formula |
C26H19ClF3N5O2
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| Molecular Weight |
525.918
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| Canonical SMILES |
O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)C1(C(=O)Nc2ccc3c(/C=C/c4ccccn4)n[nH]c3c2)CC1
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| InChI |
InChI=1S/C26H19ClF3N5O2/c27-20-8-5-16(13-19(20)26(28,29)30)32-23(36)25(10-11-25)24(37)33-17-4-7-18-21(34-35-22(18)14-17)9-6-15-3-1-2-12-31-15/h1-9,12-14H,10-11H2,(H,32,36)(H,33,37)(H,34,35)/b9-6+
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| InChIKey |
DBOXRQPVPVCSKD-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