General Information of the Compound
| Compound ID |
CP0377826
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| Compound Name |
(Z)-N-(3,5-Dichlorophenyl)-2-(4-((2,4-dioxothiazolidin-5-ylidene)methyl)phenoxy)acetamide
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| Structure |
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| Formula |
C18H12Cl2N2O4S
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| Molecular Weight |
423.277
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| Canonical SMILES |
Clc1cc(Cl)cc(NC(=O)COc2ccc(\C=C3/SC(=O)NC3=O)cc2)c1
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| InChI |
InChI=1S/C18H12Cl2N2O4S/c19-11-6-12(20)8-13(7-11)21-16(23)9-26-14-3-1-10(2-4-14)5-15-17(24)22-18(25)27-15/h1-8H,9H2,(H,21,23)(H,22,24,25)/b15-5-
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| InChIKey |
BFCMVAIAYRXAMW-WCSRMQSCSA-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
Protein ID: PT01718, Nitric oxide synthase, inducible
Protein ID: PT01062, Prostaglandin G/H synthase 2