General Information of the Compound
| Compound ID |
CP0402900
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| Compound Name |
2-[2-[4-[2-[4-(tetrazol-1-yl)phenyl]acetyl]piperazin-1-yl]ethyl]-7H-furo[3,4-b]pyridin-5-one
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| Structure |
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| Formula |
C22H23N7O3
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| Molecular Weight |
433.472
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| Canonical SMILES |
O=C(Cc1ccc(cc1)-n1cnnn1)N1CCN(CCc2ccc3C(=O)OCc3n2)CC1
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| InChI |
InChI=1S/C22H23N7O3/c30-21(13-16-1-4-18(5-2-16)29-15-23-25-26-29)28-11-9-27(10-12-28)8-7-17-3-6-19-20(24-17)14-32-22(19)31/h1-6,15H,7-14H2
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| InChIKey |
FGHSCDNBUBHJFB-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: PT03661, ATP-sensitive inward rectifier potassium channel 1
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2