General Information of the Compound
| Compound ID |
CP0475363
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| Compound Name |
3-[4-(1-pyridin-2-ylindazol-6-yl)phenyl]propanoic acid
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| Structure |
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| Formula |
C21H17N3O2
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| Molecular Weight |
343.386
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| Canonical SMILES |
OC(=O)CCc1ccc(cc1)-c1ccc2cnn(-c3ccccn3)c2c1
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| InChI |
InChI=1S/C21H17N3O2/c25-21(26)11-6-15-4-7-16(8-5-15)17-9-10-18-14-23-24(19(18)13-17)20-3-1-2-12-22-20/h1-5,7-10,12-14H,6,11H2,(H,25,26)
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| InChIKey |
AWYLQRYFNVSRHJ-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: PT04613, Free fatty acid receptor 1
Protein ID: PT04427, Free fatty acid receptor 4