General Information of the Compound
| Compound ID |
CP0498112
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| Compound Name |
N-[2-(4-chlorophenyl)ethyl]-2-(8-fluoro-4-oxoquinazolin-3-yl)acetamide
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| Structure |
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| Formula |
C18H15ClFN3O2
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| Molecular Weight |
359.788
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| Canonical SMILES |
Fc1cccc2c1ncn(CC(=O)NCCc1ccc(Cl)cc1)c2=O
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| InChI |
InChI=1S/C18H15ClFN3O2/c19-13-6-4-12(5-7-13)8-9-21-16(24)10-23-11-22-17-14(18(23)25)2-1-3-15(17)20/h1-7,11H,8-10H2,(H,21,24)
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| InChIKey |
QOKKWJMBTXOPEN-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: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02149, Transient receptor potential cation channel subfamily A member 1