General Information of the Compound
| Compound ID |
CP0365553
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| Compound Name |
4-[2,4-dichloro-5-(5,6-difluoro-1H-benzimidazol-2-yl)phenyl]sulfonylmorpholine
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| Structure |
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| Formula |
C17H13Cl2F2N3O3S
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| Molecular Weight |
448.278
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| Canonical SMILES |
Fc1cc2nc([nH]c2cc1F)-c1cc(c(Cl)cc1Cl)S(=O)(=O)N1CCOCC1
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| InChI |
InChI=1S/C17H13Cl2F2N3O3S/c18-10-6-11(19)16(28(25,26)24-1-3-27-4-2-24)5-9(10)17-22-14-7-12(20)13(21)8-15(14)23-17/h5-8H,1-4H2,(H,22,23)
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| InChIKey |
AITVCHSPKPBXJR-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