General Information of the Compound
| Compound ID |
CP0841757
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| Compound Name |
SID24822841
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| Structure |
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| Formula |
C18H13ClN2O3
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| Molecular Weight |
340.766
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| Canonical SMILES |
CC(=O)Nc1ccc(NC2=C(Cl)C(=O)c3ccccc3C2=O)cc1
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| InChI |
InChI=1S/C18H13ClN2O3/c1-10(22)20-11-6-8-12(9-7-11)21-16-15(19)17(23)13-4-2-3-5-14(13)18(16)24/h2-9,21H,1H3,(H,20,22)
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| InChIKey |
DUSWTTHAJFOFDN-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