General Information of the Compound
| Compound ID |
CP0530246
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| Compound Name |
3-(2-Bromo-4-isopropyl-phenyl)-5-methyl-7-morpholin-4-yl-3H-thiazolo[4,5-d]pyrimidine-2-thione
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| Structure |
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| Formula |
C19H21BrN4OS2
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| Molecular Weight |
465.442
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| Canonical SMILES |
CC(C)c1ccc(c(Br)c1)-n1c2nc(C)nc(N3CCOCC3)c2sc1=S
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| InChI |
InChI=1S/C19H21BrN4OS2/c1-11(2)13-4-5-15(14(20)10-13)24-18-16(27-19(24)26)17(21-12(3)22-18)23-6-8-25-9-7-23/h4-5,10-11H,6-9H2,1-3H3
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| InChIKey |
IWMUHAYJYVLRHD-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