General Information of the Compound
| Compound ID |
CP0226201
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| Compound Name |
(R)-3-methyl-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinolin-2-yl)benzo[d]thiazolo[3,2-a]imidazole
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| Structure |
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| Formula |
C26H26N4S
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| Molecular Weight |
426.589
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1sc2nc3ccccc3n2c1C
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| InChI |
InChI=1S/C26H26N4S/c1-17-6-5-14-29(17)15-13-19-9-11-21-20(16-19)10-12-23(27-21)25-18(2)30-24-8-4-3-7-22(24)28-26(30)31-25/h3-4,7-12,16-17H,5-6,13-15H2,1-2H3/t17-/m1/s1
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| InChIKey |
JHZTZJQZFCCJBJ-QGZVFWFLSA-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