General Information of the Compound
| Compound ID |
CP0405483
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| Compound Name |
3-(2-carboxyethyl)-4,6-diphenyl-1H-indole-2-carboxylic acid
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| Structure |
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| Formula |
C24H19NO4
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| Molecular Weight |
385.419
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| Canonical SMILES |
OC(=O)CCc1c([nH]c2cc(cc(-c3ccccc3)c12)-c1ccccc1)C(O)=O
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| InChI |
InChI=1S/C24H19NO4/c26-21(27)12-11-18-22-19(16-9-5-2-6-10-16)13-17(15-7-3-1-4-8-15)14-20(22)25-23(18)24(28)29/h1-10,13-14,25H,11-12H2,(H,26,27)(H,28,29)
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| InChIKey |
SSEVUBMCWYXCTC-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: PT05061, Uracil nucleotide/cysteinyl leukotriene receptor