General Information of the Compound
| Compound ID |
CP0428973
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| Compound Name |
tert-butyl 4-[3-[(1-oxo-2,3-dihydroinden-5-yl)amino]propyl]piperidine-1-carboxylate
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| Structure |
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| Formula |
C22H32N2O3
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| Molecular Weight |
372.509
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3C(=O)CCc3c2)CC1
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| InChI |
InChI=1S/C22H32N2O3/c1-22(2,3)27-21(26)24-13-10-16(11-14-24)5-4-12-23-18-7-8-19-17(15-18)6-9-20(19)25/h7-8,15-16,23H,4-6,9-14H2,1-3H3
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| InChIKey |
HDWCHQSQXHCARG-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