General Information of the Compound
| Compound ID |
CP0579242
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| Compound Name |
ethyl N-[[4-[4-(imidazol-1-ylmethyl)phenyl]-2-(2-methylpropyl)-1,3-thiazol-5-yl]sulfonyl]carbamate
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| Structure |
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| Formula |
C20H24N4O4S2
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| Molecular Weight |
448.57
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| Canonical SMILES |
CCOC(=O)NS(=O)(=O)c1sc(CC(C)C)nc1-c1ccc(Cn2ccnc2)cc1
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| InChI |
InChI=1S/C20H24N4O4S2/c1-4-28-20(25)23-30(26,27)19-18(22-17(29-19)11-14(2)3)16-7-5-15(6-8-16)12-24-10-9-21-13-24/h5-10,13-14H,4,11-12H2,1-3H3,(H,23,25)
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| InChIKey |
YUPTZRWAUXTYJD-UHFFFAOYSA-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