General Information of the Compound
| Compound ID |
CP0454185
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| Compound Name |
1-(2-chlorobenzyl)-5-(trifluoromethoxy)indoline-2,3-dione
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| Structure |
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| Formula |
C16H9ClF3NO3
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| Molecular Weight |
355.699
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| Canonical SMILES |
FC(F)(F)Oc1ccc2N(Cc3ccccc3Cl)C(=O)C(=O)c2c1
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| InChI |
InChI=1S/C16H9ClF3NO3/c17-12-4-2-1-3-9(12)8-21-13-6-5-10(24-16(18,19)20)7-11(13)14(22)15(21)23/h1-7H,8H2
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| InChIKey |
TWPKESUBTHRMAQ-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