General Information of the Compound
| Compound ID |
CP0856924
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| Compound Name |
SID24837069
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| Structure |
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| Formula |
C19H17NO5
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| Molecular Weight |
339.347
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| Canonical SMILES |
COc1ccc(-c2onc(C)c2-c2ccc3c(c2)OCCO3)c(O)c1
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| InChI |
InChI=1S/C19H17NO5/c1-11-18(12-3-6-16-17(9-12)24-8-7-23-16)19(25-20-11)14-5-4-13(22-2)10-15(14)21/h3-6,9-10,21H,7-8H2,1-2H3
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| InChIKey |
CUNGLMWGFPBDBG-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06172, Mothers against decapentaplegic homolog 3