General Information of the Compound
| Compound ID |
CP0324870
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| Compound Name |
6-[3-(4-tert-Butyl-benzoyl)-ureido]-hexanoic acid hydroxyamide
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| Structure |
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| Formula |
C18H27N3O4
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| Molecular Weight |
349.431
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)NC(=O)NCCCCCC(=O)NO
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| InChI |
InChI=1S/C18H27N3O4/c1-18(2,3)14-10-8-13(9-11-14)16(23)20-17(24)19-12-6-4-5-7-15(22)21-25/h8-11,25H,4-7,12H2,1-3H3,(H,21,22)(H2,19,20,23,24)
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| InChIKey |
XDTIBLCTJRACBX-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