General Information of the Compound
| Compound ID |
CP0968212
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| Compound Name |
(E)-3-((5-((1H-benzo[d]imidazol-2-yl)thio)furan-2-yl)methylene)pyrrolidine-2,5-dione
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| Structure |
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| Formula |
C16H11N3O3S
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| Molecular Weight |
325.349
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| Canonical SMILES |
O=C1C/C(=C\c2ccc(Sc3nc4ccccc4[nH]3)o2)C(=O)N1
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| InChI |
InChI=1S/C16H11N3O3S/c20-13-8-9(15(21)19-13)7-10-5-6-14(22-10)23-16-17-11-3-1-2-4-12(11)18-16/h1-7H,8H2,(H,17,18)(H,19,20,21)/b9-7+
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| InChIKey |
GZHPYOPPUFMDBZ-VQHVLOKHSA-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