General Information of the Compound
Compound ID |
CP0408775
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Compound Name |
3-[2,6-dimethoxy-4-(methoxymethyl)phenyl]-6-methoxy-N-(oxan-4-yl)-N-propylpyrazolo[5,1-b][1,3]thiazol-7-amine
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Structure |
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Formula |
C24H33N3O5S
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Molecular Weight |
475.611
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Canonical SMILES |
CCCN(C1CCOCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC
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InChI |
InChI=1S/C24H33N3O5S/c1-6-9-26(17-7-10-32-11-8-17)22-23(31-5)25-27-18(15-33-24(22)27)21-19(29-3)12-16(14-28-2)13-20(21)30-4/h12-13,15,17H,6-11,14H2,1-5H3
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InChIKey |
IFYKMCAPVKAGQX-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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