General Information of the Compound
| Compound ID |
CP0577522
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| Compound Name |
2-[[3-(2-methoxypyridin-4-yl)-1H-indazol-5-yl]amino]benzonitrile
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| Structure |
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| Formula |
C20H15N5O
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| Molecular Weight |
341.374
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| Canonical SMILES |
COc1cc(ccn1)-c1n[nH]c2ccc(Nc3ccccc3C#N)cc12
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| InChI |
InChI=1S/C20H15N5O/c1-26-19-10-13(8-9-22-19)20-16-11-15(6-7-18(16)24-25-20)23-17-5-3-2-4-14(17)12-21/h2-11,23H,1H3,(H,24,25)
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| InChIKey |
GPYOBNMSTMNJEI-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