General Information of the Compound
| Compound ID |
CP0458688
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| Compound Name |
(2Z)-2-[(5-nitrofuran-2-yl)methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
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| Structure |
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| Formula |
C14H7N3O4S
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| Molecular Weight |
313.294
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| Canonical SMILES |
[O-][N+](=O)c1ccc(\C=c2/sc3nc4ccccc4n3c2=O)o1
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| InChI |
InChI=1S/C14H7N3O4S/c18-13-11(7-8-5-6-12(21-8)17(19)20)22-14-15-9-3-1-2-4-10(9)16(13)14/h1-7H/b11-7-
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| InChIKey |
KVEQRHSXUQHEEK-XFFZJAGNSA-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