General Information of the Compound
| Compound ID |
CP0557487
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| Compound Name |
4-(3-((3,5-Dichlorophenyl)thio)-6-methyl-1H-indol-2-yl)butanamide
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| Structure |
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| Formula |
C19H18Cl2N2OS
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| Molecular Weight |
393.339
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| Canonical SMILES |
Cc1ccc2c(Sc3cc(Cl)cc(Cl)c3)c(CCCC(N)=O)[nH]c2c1
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| InChI |
InChI=1S/C19H18Cl2N2OS/c1-11-5-6-15-17(7-11)23-16(3-2-4-18(22)24)19(15)25-14-9-12(20)8-13(21)10-14/h5-10,23H,2-4H2,1H3,(H2,22,24)
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| InChIKey |
IXDGDLPUEYGBBL-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