General Information of the Compound
| Compound ID |
CP0476917
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| Compound Name |
2-[4-[(2-ethyl-5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]phenyl]-5-piperazin-1-yl-1,3,4-oxadiazole
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| Structure |
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| Formula |
C23H27N7O
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| Molecular Weight |
417.517
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| Canonical SMILES |
CCc1nn2c(C)cc(C)nc2c1Cc1ccc(cc1)-c1nnc(o1)N1CCNCC1
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| InChI |
InChI=1S/C23H27N7O/c1-4-20-19(21-25-15(2)13-16(3)30(21)28-20)14-17-5-7-18(8-6-17)22-26-27-23(31-22)29-11-9-24-10-12-29/h5-8,13,24H,4,9-12,14H2,1-3H3
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| InChIKey |
UHVOBMKJCCINOK-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
Protein ID: PT06238, G-protein coupled receptor 4
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2