General Information of the Compound
| Compound ID |
CP0138723
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| Compound Name |
1-[2-(cyclopropylmethoxy)ethyl]-3-[5-(2-imidazo[1,5-a]pyridin-6-ylethynyl)-4-methyl-1,3-thiazol-2-yl]urea
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| Formula |
C20H21N5O2S
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| Molecular Weight |
395.488
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| Canonical SMILES |
Cc1nc(NC(=O)NCCOCC2CC2)sc1C#Cc1ccc2cncn2c1
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| InChI |
InChI=1S/C20H21N5O2S/c1-14-18(7-5-15-4-6-17-10-21-13-25(17)11-15)28-20(23-14)24-19(26)22-8-9-27-12-16-2-3-16/h4,6,10-11,13,16H,2-3,8-9,12H2,1H3,(H2,22,23,24,26)
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| InChIKey |
HSBRXTBEKJPMLK-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