General Information of the Compound
| Compound ID |
CP0479838
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| Compound Name |
6-[2-[(3,6-dichloropyridin-2-yl)methyl]pyrazol-3-yl]-1-(1H-indazol-6-yl)benzotriazole
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| Structure |
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| Formula |
C22H14Cl2N8
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| Molecular Weight |
461.316
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| Canonical SMILES |
Clc1ccc(Cl)c(Cn2nccc2-c2ccc3nnn(-c4ccc5cn[nH]c5c4)c3c2)n1
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| InChI |
InChI=1S/C22H14Cl2N8/c23-16-4-6-22(24)27-19(16)12-31-20(7-8-26-31)13-2-5-17-21(9-13)32(30-29-17)15-3-1-14-11-25-28-18(14)10-15/h1-11H,12H2,(H,25,28)
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| InChIKey |
CCTZUGOXQUQTAJ-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