General Information of the Compound
| Compound ID |
CP0441078
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| Compound Name |
4-(4-fluorophenyl)-2-[(4-fluorophenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
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| Structure |
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| Formula |
C20H17F2N3
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| Molecular Weight |
337.373
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| Canonical SMILES |
Fc1ccc(Cc2nc3CCNCc3c(n2)-c2ccc(F)cc2)cc1
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| InChI |
InChI=1S/C20H17F2N3/c21-15-5-1-13(2-6-15)11-19-24-18-9-10-23-12-17(18)20(25-19)14-3-7-16(22)8-4-14/h1-8,23H,9-12H2
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| InChIKey |
ICXYYFPLSKPKJE-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C