General Information of the Compound
Compound ID |
CP0575431
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Compound Name |
N-[4-(4-fluorophenyl)butyl]-6-(1-methylpiperidin-4-yl)-2-oxo-1,3-benzoxazole-3-carboxamide
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Structure |
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Formula |
C24H28FN3O3
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Molecular Weight |
425.504
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Canonical SMILES |
CN1CCC(CC1)c1ccc2n(C(=O)NCCCCc3ccc(F)cc3)c(=O)oc2c1
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InChI |
InChI=1S/C24H28FN3O3/c1-27-14-11-18(12-15-27)19-7-10-21-22(16-19)31-24(30)28(21)23(29)26-13-3-2-4-17-5-8-20(25)9-6-17/h5-10,16,18H,2-4,11-15H2,1H3,(H,26,29)
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InChIKey |
ZHEWHJLWOYDYLJ-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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