General Information of the Compound
| Compound ID |
CP0393883
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| Compound Name |
3-(2-carboxyethyl)-7-fluoro-6-phenyl-1H-indole-2-carboxylic acid
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| Structure |
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| Formula |
C18H14FNO4
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| Molecular Weight |
327.311
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| Canonical SMILES |
OC(=O)CCc1c([nH]c2c(F)c(ccc12)-c1ccccc1)C(O)=O
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| InChI |
InChI=1S/C18H14FNO4/c19-15-11(10-4-2-1-3-5-10)6-7-12-13(8-9-14(21)22)17(18(23)24)20-16(12)15/h1-7,20H,8-9H2,(H,21,22)(H,23,24)
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| InChIKey |
RQGJXIIJLHDIGB-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