General Information of the Compound
| Compound ID |
CP0957745
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| Compound Name |
(Z)-3-isopropyl-5-((5-(6-(trifluoromethyl)-1H-benzo[d]imidazol-2-ylthio)furan-2-yl)methylene)thiazolidine-2,4-dione
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| Structure |
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| Formula |
C19H14F3N3O3S2
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| Molecular Weight |
453.467
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| Canonical SMILES |
CC(C)N1C(=O)S/C(=C\c2ccc(Sc3nc4ccc(C(F)(F)F)cc4[nH]3)o2)C1=O
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| InChI |
InChI=1S/C19H14F3N3O3S2/c1-9(2)25-16(26)14(29-18(25)27)8-11-4-6-15(28-11)30-17-23-12-5-3-10(19(20,21)22)7-13(12)24-17/h3-9H,1-2H3,(H,23,24)/b14-8-
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| InChIKey |
BCHBNZAEIMYMSI-ZSOIEALJSA-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