General Information of the Compound
| Compound ID |
CP0336511
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| Compound Name |
3-[1-(3-cyanophenyl)imidazo[1,5-a]pyridin-6-yl]-2,2-dimethyl-3-phenyl-N-(1,3-thiazol-2-yl)propanamide
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| Structure |
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| Formula |
C28H23N5OS
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| Molecular Weight |
477.593
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| Canonical SMILES |
CC(C)(C(c1ccccc1)c1ccc2c(ncn2c1)-c1cccc(c1)C#N)C(=O)Nc1nccs1
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| InChI |
InChI=1S/C28H23N5OS/c1-28(2,26(34)32-27-30-13-14-35-27)24(20-8-4-3-5-9-20)22-11-12-23-25(31-18-33(23)17-22)21-10-6-7-19(15-21)16-29/h3-15,17-18,24H,1-2H3,(H,30,32,34)
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| InChIKey |
PURZKEBMOSRQBC-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