General Information of the Compound
| Compound ID |
CP0495907
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| Compound Name |
(5Z)-5-[[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-methylimino-1,3-thiazolidin-4-one
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| Structure |
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| Formula |
C17H16FN3OS
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| Molecular Weight |
329.4
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| Canonical SMILES |
C\N=C1\NC(=O)\C(S1)=C\c1cc(C)n(c1C)-c1ccccc1F
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| InChI |
InChI=1S/C17H16FN3OS/c1-10-8-12(9-15-16(22)20-17(19-3)23-15)11(2)21(10)14-7-5-4-6-13(14)18/h4-9H,1-3H3,(H,19,20,22)/b15-9-
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| InChIKey |
MPCYJIHJJZOVPW-DHDCSXOGSA-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