General Information of the Compound
| Compound ID |
CP0472596
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| Compound Name |
US8853203, 44
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| Structure |
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| Formula |
C24H26N2O4
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| Molecular Weight |
406.482
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| Canonical SMILES |
COCCOCc1cccc2C3=CC(=NCC(=O)N3CCc12)c1cccc(OC)c1
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| InChI |
InChI=1S/C24H26N2O4/c1-28-11-12-30-16-18-6-4-8-21-20(18)9-10-26-23(21)14-22(25-15-24(26)27)17-5-3-7-19(13-17)29-2/h3-8,13-14H,9-12,15-16H2,1-2H3
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| InChIKey |
ZPJLLLWUSJVREL-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: PT01994, Metabotropic glutamate receptor 1
Protein ID: PT00854, Metabotropic glutamate receptor 5