General Information of the Compound
| Compound ID |
CP0397157
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| Compound Name |
4-methoxy-N-[4-phenyl-5-(pyridine-3-carbonyl)-1,3-thiazol-2-yl]benzamide
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| Structure |
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| Formula |
C23H17N3O3S
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| Molecular Weight |
415.474
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| Canonical SMILES |
COc1ccc(cc1)C(=O)Nc1nc(c(s1)C(=O)c1cccnc1)-c1ccccc1
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| InChI |
InChI=1S/C23H17N3O3S/c1-29-18-11-9-16(10-12-18)22(28)26-23-25-19(15-6-3-2-4-7-15)21(30-23)20(27)17-8-5-13-24-14-17/h2-14H,1H3,(H,25,26,28)
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| InChIKey |
OGFOEXOGICQACP-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
Protein ID: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a
Protein ID: PT01278, Adenosine receptor A2b
Protein ID: PT01279, Adenosine receptor A3