General Information of the Compound
| Compound ID |
CP0433435
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| Compound Name |
3-[(5-tert-butyl-2-methylfuran-3-carbonyl)amino]-3-(4-methylphenyl)propanoic acid
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| Structure |
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| Formula |
C20H25NO4
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| Molecular Weight |
343.423
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| Canonical SMILES |
Cc1oc(cc1C(=O)NC(CC(O)=O)c1ccc(C)cc1)C(C)(C)C
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| InChI |
InChI=1S/C20H25NO4/c1-12-6-8-14(9-7-12)16(11-18(22)23)21-19(24)15-10-17(20(3,4)5)25-13(15)2/h6-10,16H,11H2,1-5H3,(H,21,24)(H,22,23)
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| InChIKey |
XPRQEFPTFTXAHY-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