General Information of the Compound
| Compound ID |
CP0202340
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| Compound Name |
4-[[5-(5-bromo-1H-indol-2-yl)imidazol-1-yl]methyl]benzonitrile
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| Structure |
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| Formula |
C19H13BrN4
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| Molecular Weight |
377.245
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| Canonical SMILES |
Brc1ccc2[nH]c(cc2c1)-c1cncn1Cc1ccc(cc1)C#N
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| InChI |
InChI=1S/C19H13BrN4/c20-16-5-6-17-15(7-16)8-18(23-17)19-10-22-12-24(19)11-14-3-1-13(9-21)2-4-14/h1-8,10,12,23H,11H2
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| InChIKey |
ZSBHOCVLOMTACK-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