General Information of the Compound
| Compound ID |
CP0551713
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| Compound Name |
N-[5-[[(1R)-1-[1-ethyl-6-(trifluoromethyl)benzimidazol-2-yl]ethyl]sulfamoyl]-1,3-thiazol-2-yl]acetamide
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| Structure |
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| Formula |
C17H18F3N5O3S2
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| Molecular Weight |
461.491
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| Canonical SMILES |
CCn1c(nc2ccc(cc12)C(F)(F)F)[C@@H](C)NS(=O)(=O)c1cnc(NC(C)=O)s1
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| InChI |
InChI=1S/C17H18F3N5O3S2/c1-4-25-13-7-11(17(18,19)20)5-6-12(13)23-15(25)9(2)24-30(27,28)14-8-21-16(29-14)22-10(3)26/h5-9,24H,4H2,1-3H3,(H,21,22,26)/t9-/m1/s1
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| InChIKey |
QTVQYVQTBJADQN-SECBINFHSA-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