General Information of the Compound
| Compound ID |
CP0460349
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| Compound Name |
(5E)-5-[[5-(3,4-difluorophenyl)thiophen-2-yl]methylidene]-2-sulfanylideneimidazolidin-4-one
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| Structure |
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| Formula |
C14H8F2N2OS2
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| Molecular Weight |
322.361
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| Canonical SMILES |
Fc1ccc(cc1F)-c1ccc(\C=C2\NC(=S)NC2=O)s1
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| InChI |
InChI=1S/C14H8F2N2OS2/c15-9-3-1-7(5-10(9)16)12-4-2-8(21-12)6-11-13(19)18-14(20)17-11/h1-6H,(H2,17,18,19,20)/b11-6+
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| InChIKey |
PDIBNRZVLUECNJ-IZZDOVSWSA-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