General Information of the Compound
| Compound ID |
CP0467898
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| Compound Name |
4-fluoro-N-(3-(1-(2-hydroxyethyl)piperidin-4-yl)-1H-indol-5-yl)benzamide
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| Structure |
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| Formula |
C22H24FN3O2
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| Molecular Weight |
381.451
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| Canonical SMILES |
OCCN1CCC(CC1)c1c[nH]c2ccc(NC(=O)c3ccc(F)cc3)cc12
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| InChI |
InChI=1S/C22H24FN3O2/c23-17-3-1-16(2-4-17)22(28)25-18-5-6-21-19(13-18)20(14-24-21)15-7-9-26(10-8-15)11-12-27/h1-6,13-15,24,27H,7-12H2,(H,25,28)
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| InChIKey |
XATLLXPHWUBXET-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: PT01202, 5-hydroxytryptamine receptor 1B
Protein ID: PT00827, 5-hydroxytryptamine receptor 1D