General Information of the Compound
| Compound ID |
CP0076276
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| Compound Name |
2-(3-chloro-4-fluorophenyl)-7-hydroxy-N-(3-imidazol-1-ylpropyl)-1H-benzimidazole-4-carboxamide
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| Structure |
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| Formula |
C20H17ClFN5O2
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| Molecular Weight |
413.84
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| Canonical SMILES |
Oc1ccc(C(=O)NCCCn2ccnc2)c2[nH]c(nc12)-c1ccc(F)c(Cl)c1
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| InChI |
InChI=1S/C20H17ClFN5O2/c21-14-10-12(2-4-15(14)22)19-25-17-13(3-5-16(28)18(17)26-19)20(29)24-6-1-8-27-9-7-23-11-27/h2-5,7,9-11,28H,1,6,8H2,(H,24,29)(H,25,26)
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| InChIKey |
LIGIIYFIBGCDCU-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