General Information of the Compound
| Compound ID |
CP0390270
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| Compound Name |
US8853203, 12
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| Structure |
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| Formula |
C23H24N2O4
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| Molecular Weight |
392.455
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| Canonical SMILES |
COCCOc1cccc(c1)C1=NCC(=O)N2CCc3c(OC)cccc3C2=C1
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| InChI |
InChI=1S/C23H24N2O4/c1-27-11-12-29-17-6-3-5-16(13-17)20-14-21-18-7-4-8-22(28-2)19(18)9-10-25(21)23(26)15-24-20/h3-8,13-14H,9-12,15H2,1-2H3
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| InChIKey |
ZMAWUCGAPUTZLE-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