General Information of the Compound
| Compound ID |
CP0558174
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| Compound Name |
5-[2-(3-naphthalen-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]pentan-1-ol
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| Structure |
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| Formula |
C21H25N3O2
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| Molecular Weight |
351.45
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| Canonical SMILES |
OCCCCCN1CCCC1c1nc(no1)-c1ccc2ccccc2c1
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| InChI |
InChI=1S/C21H25N3O2/c25-14-5-1-4-12-24-13-6-9-19(24)21-22-20(23-26-21)18-11-10-16-7-2-3-8-17(16)15-18/h2-3,7-8,10-11,15,19,25H,1,4-6,9,12-14H2
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| InChIKey |
XFLHXNSJGVOJTG-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