General Information of the Compound
| Compound ID |
CP0551264
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| Compound Name |
5-[2-(5-chloro-2-phenylmethoxyphenyl)-5-methylpyrrol-1-yl]-2H-benzotriazole
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| Structure |
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| Formula |
C24H19ClN4O
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| Molecular Weight |
414.896
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| Canonical SMILES |
Cc1ccc(-c2cc(Cl)ccc2OCc2ccccc2)n1-c1ccc2nn[nH]c2c1
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| InChI |
InChI=1S/C24H19ClN4O/c1-16-7-11-23(29(16)19-9-10-21-22(14-19)27-28-26-21)20-13-18(25)8-12-24(20)30-15-17-5-3-2-4-6-17/h2-14H,15H2,1H3,(H,26,27,28)
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| InChIKey |
AYJUIAGESMWXBZ-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