General Information of the Compound
| Compound ID |
CP0478423
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| Compound Name |
(2,2,3,3-tetrafluorocyclobutyl) 4-[5-[(3-cyanopyridin-4-yl)methoxy]pyrimidin-2-yl]piperazine-1-carboxylate
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| Structure |
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| Formula |
C20H18F4N6O3
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| Molecular Weight |
466.395
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| Canonical SMILES |
FC1(F)CC(OC(=O)N2CCN(CC2)c2ncc(OCc3ccncc3C#N)cn2)C1(F)F
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| InChI |
InChI=1S/C20H18F4N6O3/c21-19(22)7-16(20(19,23)24)33-18(31)30-5-3-29(4-6-30)17-27-10-15(11-28-17)32-12-13-1-2-26-9-14(13)8-25/h1-2,9-11,16H,3-7,12H2
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| InChIKey |
XIRILMVYBXFZOO-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: PT02455, Glucose-dependent insulinotropic receptor
Protein ID: PT02398, Glucose-dependent insulinotropic receptor