General Information of the Compound
| Compound ID |
CP0429197
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| Compound Name |
BDBM308246
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| Structure |
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| Formula |
C23H19FN6O
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| Molecular Weight |
414.444
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| Canonical SMILES |
Fc1cccc(n1)-c1cccc2C3=CC(=NCC(=O)N3CCc12)n1cnc(n1)C1CC1
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| InChI |
InChI=1S/C23H19FN6O/c24-20-6-2-5-18(27-20)16-3-1-4-17-15(16)9-10-29-19(17)11-21(25-12-22(29)31)30-13-26-23(28-30)14-7-8-14/h1-6,11,13-14H,7-10,12H2
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| InChIKey |
KQVKINXXQMQNIB-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