General Information of the Compound
| Compound ID |
CP0412514
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| Compound Name |
(4-chlorophenyl) 5-methyl-2-propan-2-ylbenzoate
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| Structure |
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| Formula |
C17H17ClO2
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| Molecular Weight |
288.774
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| Canonical SMILES |
CC(C)c1ccc(C)cc1C(=O)Oc1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H17ClO2/c1-11(2)15-9-4-12(3)10-16(15)17(19)20-14-7-5-13(18)6-8-14/h4-11H,1-3H3
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| InChIKey |
HOUNKQLDMFHDAI-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: PT05529, Transient receptor potential cation channel subfamily M member 8