General Information of the Compound
Compound ID |
CP0419110
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Compound Name |
(2,2,3,3-Tetramethylcyclopropyl)(1-(2-(thiophen-2-yl)ethyl)-1H-indol-3-yl)methanone
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Structure |
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Formula |
C22H25NOS
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Molecular Weight |
351.515
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Canonical SMILES |
CC1(C)C(C(=O)c2cn(CCc3cccs3)c3ccccc23)C1(C)C
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InChI |
InChI=1S/C22H25NOS/c1-21(2)20(22(21,3)4)19(24)17-14-23(12-11-15-8-7-13-25-15)18-10-6-5-9-16(17)18/h5-10,13-14,20H,11-12H2,1-4H3
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InChIKey |
YWZNODBTGLYMLC-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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