General Information of the Compound
| Compound ID |
CP0846298
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| Compound Name |
SID99360857
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| Structure |
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| Formula |
C18H17Cl2NO3
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| Molecular Weight |
366.244
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| Canonical SMILES |
CC(=O)NC(CCc1ccc(Cl)c(Cl)c1)c1cccc(O)c(=O)c1
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| InChI |
InChI=1S/C18H17Cl2NO3/c1-11(22)21-16(13-3-2-4-17(23)18(24)10-13)8-6-12-5-7-14(19)15(20)9-12/h2-5,7,9-10,16H,6,8H2,1H3,(H,21,22)(H,23,24)
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| InChIKey |
MIGSPHGJQIIJCX-UHFFFAOYSA-N
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| CAS |
71856-94-5
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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: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06124, Paired box protein Pax-8