General Information of the Compound
| Compound ID |
CP0541339
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| Compound Name |
1-ethyl-N-[(1R)-1-[1-ethyl-6-(trifluoromethyl)benzimidazol-2-yl]ethyl]pyrazole-4-sulfonamide
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| Structure |
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| Formula |
C17H20F3N5O2S
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| Molecular Weight |
415.441
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| Canonical SMILES |
CCn1cc(cn1)S(=O)(=O)N[C@H](C)c1nc2ccc(cc2n1CC)C(F)(F)F
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| InChI |
InChI=1S/C17H20F3N5O2S/c1-4-24-10-13(9-21-24)28(26,27)23-11(3)16-22-14-7-6-12(17(18,19)20)8-15(14)25(16)5-2/h6-11,23H,4-5H2,1-3H3/t11-/m1/s1
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| InChIKey |
NBUCDIQFOXMYJN-LLVKDONJSA-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