General Information of the Compound
| Compound ID |
CP0037303
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| Compound Name |
ADD-3878
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| Synonyms |
(+-)-5-(p-((1-Methylcyclohexyl)methoxy)benzyl)-2,4-thiazolidinedione
(+/-)-5-[4-(1-Methylcyclohexylmethoxy)benzyl]thiazolidine-2,4-dione
5-(4-((1-methylcyclohexyl)methoxy)benzyl)thiazolidine-2,4-dione
5-{4-[(1-methylcyclohexyl)methoxy]benzyl}-1,3-thiazolidine-2,4-dione
74772-77-3
ADD 3878
ADD-3878
C18H23NO3S
CHEBI:64227
Ciglitazona
Ciglitazona [Spanish]
Ciglitazone
Ciglitazone [USAN:INN]
Ciglitazonum
Ciglitazonum [Latin]
Ciglitizone
NCGC00164446-01
U 63287
U-63287
YZFWTZACSRHJQD-UHFFFAOYSA-N
ciglitazone
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| Structure |
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| Formula |
C18H23NO3S
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| Molecular Weight |
333.453
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| Canonical SMILES |
CC1(COc2ccc(CC3SC(=O)NC3=O)cc2)CCCCC1
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| InChI |
InChI=1S/C18H23NO3S/c1-18(9-3-2-4-10-18)12-22-14-7-5-13(6-8-14)11-15-16(20)19-17(21)23-15/h5-8,15H,2-4,9-12H2,1H3,(H,19,20,21)
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| InChIKey |
YZFWTZACSRHJQD-UHFFFAOYSA-N
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| CAS |
74772-77-3
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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: PT00820, Acetylcholinesterase
Protein ID: PT00918, Amine oxidase [flavin-containing] A
Protein ID: PT04542, Bile salt export pump
Protein ID: PT01552, Nuclear receptor subfamily 1 group I member 2
Protein ID: PT02973, Peroxisome proliferator-activated receptor gamma
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma
Clinical Information about the Compound