General Information of the Compound
| Compound ID |
CP0410835
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| Compound Name |
5-methylsulfanyl-6-(1,1,2,2,2-pentafluoroethyl)-N-pyridin-3-yl-2,3-dihydroindole-1-carboxamide
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| Structure |
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| Formula |
C17H14F5N3OS
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| Molecular Weight |
403.376
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| Canonical SMILES |
CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)C(F)(F)F
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| InChI |
InChI=1S/C17H14F5N3OS/c1-27-14-7-10-4-6-25(15(26)24-11-3-2-5-23-9-11)13(10)8-12(14)16(18,19)17(20,21)22/h2-3,5,7-9H,4,6H2,1H3,(H,24,26)
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| InChIKey |
CGYUZGMBQZEWFR-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: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C