General Information of the Compound
| Compound ID |
CP0869513
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| Compound Name |
(E)-N1-(3-(2-(Pyridin-2-yl)vinyl)-1H-indazol-6-yl)-N3-(m-tolyl)malonamide
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| Structure |
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| Formula |
C24H21N5O2
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| Molecular Weight |
411.465
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| Canonical SMILES |
Cc1cccc(NC(=O)CC(=O)Nc2ccc3c(/C=C/c4ccccn4)n[nH]c3c2)c1
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| InChI |
InChI=1S/C24H21N5O2/c1-16-5-4-7-18(13-16)26-23(30)15-24(31)27-19-8-10-20-21(28-29-22(20)14-19)11-9-17-6-2-3-12-25-17/h2-14H,15H2,1H3,(H,26,30)(H,27,31)(H,28,29)/b11-9+
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| InChIKey |
JHAWNFKVMKJFJZ-PKNBQFBNSA-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