General Information of the Compound
| Compound ID |
CP0419683
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| Compound Name |
2-arylbenzimidazole derivative, 3
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| Structure |
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| Formula |
C25H33ClN4O
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| Molecular Weight |
441.019
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| Canonical SMILES |
CN1CCN(CCCOc2ccc(-c3nc4ccc(cc4[nH]3)C(C)(C)C)c(Cl)c2)CC1
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| InChI |
InChI=1S/C25H33ClN4O/c1-25(2,3)18-6-9-22-23(16-18)28-24(27-22)20-8-7-19(17-21(20)26)31-15-5-10-30-13-11-29(4)12-14-30/h6-9,16-17H,5,10-15H2,1-4H3,(H,27,28)
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| InChIKey |
ZPKHJXYJHFUOGM-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