General Information of the Compound
| Compound ID |
CP0205353
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| Compound Name |
N-(Aryl)-thiazole-5-carboxamide 23
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| Structure |
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| Formula |
C21H22N4O2S
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| Molecular Weight |
394.5
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| Canonical SMILES |
O=C(Nc1ccc(cc1)N1CCOCC1)c1scnc1CCc1ccncc1
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| InChI |
InChI=1S/C21H22N4O2S/c26-21(20-19(23-15-28-20)6-1-16-7-9-22-10-8-16)24-17-2-4-18(5-3-17)25-11-13-27-14-12-25/h2-5,7-10,15H,1,6,11-14H2,(H,24,26)
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| InChIKey |
DPGSHJNUIUYMMW-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