General Information of the Compound
| Compound ID |
CP0450149
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| Compound Name |
US8853203, 95-1
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| Structure |
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| Formula |
C24H22N6O
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| Molecular Weight |
410.481
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| Canonical SMILES |
Cc1ccc(cn1)-c1ccnc2C3=CC(=NCC(=O)N3CCc12)n1cnc(c1)C1CC1
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| InChI |
InChI=1S/C24H22N6O/c1-15-2-3-17(11-26-15)18-6-8-25-24-19(18)7-9-30-21(24)10-22(27-12-23(30)31)29-13-20(28-14-29)16-4-5-16/h2-3,6,8,10-11,13-14,16H,4-5,7,9,12H2,1H3
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| InChIKey |
CHIBWIIRFQBOEN-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