General Information of the Compound
| Compound ID |
CP0430004
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| Compound Name |
4-[4-(3-naphthalen-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]butanoic acid
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| Structure |
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| Formula |
C21H23N3O3
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| Molecular Weight |
365.433
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| Canonical SMILES |
OC(=O)CCCN1CCC(CC1)c1nc(no1)-c1ccc2ccccc2c1
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| InChI |
InChI=1S/C21H23N3O3/c25-19(26)6-3-11-24-12-9-16(10-13-24)21-22-20(23-27-21)18-8-7-15-4-1-2-5-17(15)14-18/h1-2,4-5,7-8,14,16H,3,6,9-13H2,(H,25,26)
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| InChIKey |
LWHDDWRMDZBFEN-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