General Information of the Compound
| Compound ID |
CP0534723
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| Compound Name |
N-methyl-N-[5-(6-morpholin-4-yl-4-oxopyran-2-yl)-9H-thioxanthen-2-yl]acetamide
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| Formula |
C25H24N2O4S
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| Molecular Weight |
448.544
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| Canonical SMILES |
CN(C(C)=O)c1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
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| InChI |
InChI=1S/C25H24N2O4S/c1-16(28)26(2)19-6-7-23-18(13-19)12-17-4-3-5-21(25(17)32-23)22-14-20(29)15-24(31-22)27-8-10-30-11-9-27/h3-7,13-15H,8-12H2,1-2H3
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| InChIKey |
KRGLTEGRRGTLAH-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