General Information of the Compound
| Compound ID |
CP0857140
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| Compound Name |
rac-1,2,3,4-Tetrahydro-4-(3-methoxyphenyl)-2-thioxo-5H-indeno[1,2-d]pyrimidin-5-one
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| Structure |
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| Formula |
C18H14N2O2S
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| Molecular Weight |
322.389
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| Canonical SMILES |
COc1cccc(C2NC(=S)NC3=C2C(=O)c2ccccc23)c1
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| InChI |
InChI=1S/C18H14N2O2S/c1-22-11-6-4-5-10(9-11)15-14-16(20-18(23)19-15)12-7-2-3-8-13(12)17(14)21/h2-9,15H,1H3,(H2,19,20,23)
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| InChIKey |
DRBIJLJBIZNBSI-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