General Information of the Compound
| Compound ID |
CP0501349
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| Compound Name |
4-Methoxy-3-methyl-N-(3-phenyl-[1,2,4]thiadiazol-5-yl)-benzamide
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| Structure |
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| Formula |
C17H15N3O2S
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| Molecular Weight |
325.393
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| Canonical SMILES |
COc1ccc(cc1C)C(=O)Nc1nc(ns1)-c1ccccc1
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| InChI |
InChI=1S/C17H15N3O2S/c1-11-10-13(8-9-14(11)22-2)16(21)19-17-18-15(20-23-17)12-6-4-3-5-7-12/h3-10H,1-2H3,(H,18,19,20,21)
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| InChIKey |
WWAIENLNWVSYGE-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