General Information of the Compound
| Compound ID |
CP0408358
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| Compound Name |
2-(4-chlorophenyl)-6-[3-methoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]-[1,3]thiazolo[4,5-d]pyrimidin-7-one
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| Structure |
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| Formula |
C24H23ClN4O3S
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| Molecular Weight |
482.993
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| Canonical SMILES |
COc1cc(ccc1OCCN1CCCC1)-n1cnc2nc(sc2c1=O)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C24H23ClN4O3S/c1-31-20-14-18(8-9-19(20)32-13-12-28-10-2-3-11-28)29-15-26-22-21(24(29)30)33-23(27-22)16-4-6-17(25)7-5-16/h4-9,14-15H,2-3,10-13H2,1H3
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| InChIKey |
VVBMGZYZYBRLCY-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