General Information of the Compound
| Compound ID |
CP0181432
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| Compound Name |
1-(azetidin-1-yl)-2-[6-[2-[(1S,2R)-2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethoxy]pyridin-3-yl]ethanone
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| Structure |
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| Formula |
C24H30ClN5O2
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| Molecular Weight |
455.99
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| Canonical SMILES |
Clc1cnc(nc1)N1CCC(CC1)[C@H]1C[C@H]1CCOc1ccc(CC(=O)N2CCC2)cn1
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| InChI |
InChI=1S/C24H30ClN5O2/c25-20-15-27-24(28-16-20)30-9-4-18(5-10-30)21-13-19(21)6-11-32-22-3-2-17(14-26-22)12-23(31)29-7-1-8-29/h2-3,14-16,18-19,21H,1,4-13H2/t19-,21-/m1/s1
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| InChIKey |
LBYBPUSGLLAODS-TZIWHRDSSA-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: PT02398, Glucose-dependent insulinotropic receptor
Protein ID: PT02455, Glucose-dependent insulinotropic receptor