General Information of the Compound
| Compound ID |
CP0968180
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| Compound Name |
6-fluoro-1-propyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole hydrochloride
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| Structure |
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| Formula |
C14H18ClFN2
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| Molecular Weight |
268.763
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| Canonical SMILES |
CCCC1NCCc2c1[nH]c1ccc(F)cc21.Cl
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| InChI |
InChI=1S/C14H17FN2.ClH/c1-2-3-13-14-10(6-7-16-13)11-8-9(15)4-5-12(11)17-14;/h4-5,8,13,16-17H,2-3,6-7H2,1H3;1H
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| InChIKey |
HQGVZJJQYNBEPI-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