General Information of the Compound
| Compound ID |
CP0454200
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| Compound Name |
7-fluoro-1-(4-(trifluoromethyl)benzyl)indoline-2,3-dione
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| Structure |
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| Formula |
C16H9F4NO2
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| Molecular Weight |
323.245
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| Canonical SMILES |
Fc1cccc2C(=O)C(=O)N(Cc3ccc(cc3)C(F)(F)F)c12
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| InChI |
InChI=1S/C16H9F4NO2/c17-12-3-1-2-11-13(12)21(15(23)14(11)22)8-9-4-6-10(7-5-9)16(18,19)20/h1-7H,8H2
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| InChIKey |
KXXRXMVVPVEVCB-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: PT01913, Muscarinic acetylcholine receptor M1
Protein ID: PT01516, Muscarinic acetylcholine receptor M5