General Information of the Compound
| Compound ID |
CP0957746
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| Compound Name |
(Z)-5-((5-((5,6-dichloro-1H-benzo[d]imidazol-2-yl)thio)furan-2-yl)methylene)-3-isopropylthiazolidine-2,4-dione
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| Structure |
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| Formula |
C18H13Cl2N3O3S2
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| Molecular Weight |
454.36
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| Canonical SMILES |
CC(C)N1C(=O)S/C(=C\c2ccc(Sc3nc4cc(Cl)c(Cl)cc4[nH]3)o2)C1=O
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| InChI |
InChI=1S/C18H13Cl2N3O3S2/c1-8(2)23-16(24)14(27-18(23)25)5-9-3-4-15(26-9)28-17-21-12-6-10(19)11(20)7-13(12)22-17/h3-8H,1-2H3,(H,21,22)/b14-5-
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| InChIKey |
INTIUWQHQFYTJP-RZNTYIFUSA-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