General Information of the Compound
| Compound ID |
CP0408417
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| Compound Name |
4,6-dichloro-5-methylsulfanyl-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
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| Structure |
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| Formula |
C15H13Cl2N3OS
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| Molecular Weight |
354.262
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| Canonical SMILES |
CSc1c(Cl)cc2N(CCc2c1Cl)C(=O)Nc1cccnc1
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| InChI |
InChI=1S/C15H13Cl2N3OS/c1-22-14-11(16)7-12-10(13(14)17)4-6-20(12)15(21)19-9-3-2-5-18-8-9/h2-3,5,7-8H,4,6H2,1H3,(H,19,21)
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| InChIKey |
GUPRPPNDFYELMC-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
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C