General Information of the Compound
| Compound ID |
CP0448930
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| Compound Name |
3,5-dimethoxy-4-[6-methoxy-7-[oxan-4-yl(propyl)amino]pyrazolo[5,1-b][1,3]thiazol-3-yl]benzonitrile
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| Structure |
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| Formula |
C23H28N4O4S
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| Molecular Weight |
456.568
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| Canonical SMILES |
CCCN(C1CCOCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(cc1OC)C#N
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| InChI |
InChI=1S/C23H28N4O4S/c1-5-8-26(16-6-9-31-10-7-16)21-22(30-4)25-27-17(14-32-23(21)27)20-18(28-2)11-15(13-24)12-19(20)29-3/h11-12,14,16H,5-10H2,1-4H3
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| InChIKey |
FVSOFTHRHPHMQC-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