General Information of the Compound
| Compound ID |
CP0847394
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| Compound Name |
tert-butyl 4-(3-(3-oxo-2,3-dihydrobenzofuran-6-ylamino)propyl)piperidine-1-carboxylate
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| Structure |
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| Formula |
C21H30N2O4
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| Molecular Weight |
374.481
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(c2)OCC3=O)CC1
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| InChI |
InChI=1S/C21H30N2O4/c1-21(2,3)27-20(25)23-11-8-15(9-12-23)5-4-10-22-16-6-7-17-18(24)14-26-19(17)13-16/h6-7,13,15,22H,4-5,8-12,14H2,1-3H3
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| InChIKey |
MSLGCJRBTZTIQC-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