General Information of the Compound
Compound ID |
CP0475354
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Compound Name |
(5Z)-5-[[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-(2-hydroxyethylimino)-3-methyl-1,3-thiazolidin-4-one
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Formula |
C19H20FN3O2S
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Molecular Weight |
373.453
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Canonical SMILES |
CN1C(=O)\C(S\C1=N/CCO)=C\c1cc(C)n(c1C)-c1ccccc1F
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InChI |
InChI=1S/C19H20FN3O2S/c1-12-10-14(13(2)23(12)16-7-5-4-6-15(16)20)11-17-18(25)22(3)19(26-17)21-8-9-24/h4-7,10-11,24H,8-9H2,1-3H3/b17-11-,21-19-
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InChIKey |
TVXTWFLZHMOJAY-WQZDFCHPSA-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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