General Information of the Compound
| Compound ID |
CP0900314
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| Compound Name |
2-(2-Isopropoxy-3-methyl-benzoylamino)-5-methoxy-indan-2-carboxylic acid
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| Structure |
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| Formula |
C22H25NO5
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| Molecular Weight |
383.444
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| Canonical SMILES |
COc1ccc2c(c1)CC(NC(=O)c1cccc(C)c1OC(C)C)(C(=O)O)C2
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| InChI |
InChI=1S/C22H25NO5/c1-13(2)28-19-14(3)6-5-7-18(19)20(24)23-22(21(25)26)11-15-8-9-17(27-4)10-16(15)12-22/h5-10,13H,11-12H2,1-4H3,(H,23,24)(H,25,26)
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| InChIKey |
ZFNNJCNJQGPLHU-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