General Information of the Compound
| Compound ID |
CP0400848
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| Compound Name |
1-(4-bromo-2-fluorobenzyl)-7-chloroindoline-2,3-dione
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| Structure |
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| Formula |
C15H8BrClFNO2
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| Molecular Weight |
368.589
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| Canonical SMILES |
Fc1cc(Br)ccc1CN1C(=O)C(=O)c2cccc(Cl)c12
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| InChI |
InChI=1S/C15H8BrClFNO2/c16-9-5-4-8(12(18)6-9)7-19-13-10(14(20)15(19)21)2-1-3-11(13)17/h1-6H,7H2
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| InChIKey |
DHTZABNLHNWPEC-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