General Information of the Compound
| Compound ID |
CP0854620
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| Compound Name |
rac-4-(3-methoxyphenyl)-3-methyl-2-thioxo-3,4-dihydro-1H-indeno[1,2-d]pyrimidin-5(2H)-one
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| Structure |
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| Formula |
C19H16N2O2S
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| Molecular Weight |
336.416
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| Canonical SMILES |
COc1cccc(C2C3=C(NC(=S)N2C)c2ccccc2C3=O)c1
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| InChI |
InChI=1S/C19H16N2O2S/c1-21-17(11-6-5-7-12(10-11)23-2)15-16(20-19(21)24)13-8-3-4-9-14(13)18(15)22/h3-10,17H,1-2H3,(H,20,24)
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| InChIKey |
UOCMRDFQMNTZKK-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