General Information of the Compound
| Compound ID |
CP0335294
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| Compound Name |
4-[[(4-tert-butylbenzoyl)amino]methyl]-2-fluorobenzoic acid
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| Structure |
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| Formula |
C19H20FNO3
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| Molecular Weight |
329.371
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)NCc1ccc(C(O)=O)c(F)c1
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| InChI |
InChI=1S/C19H20FNO3/c1-19(2,3)14-7-5-13(6-8-14)17(22)21-11-12-4-9-15(18(23)24)16(20)10-12/h4-10H,11H2,1-3H3,(H,21,22)(H,23,24)
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| InChIKey |
QAAWIANKHPYHEF-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