General Information of the Compound
| Compound ID |
CP0639030
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| Compound Name |
5-(7-chloro-2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)-N-(4-fluoro-2-methylbenzyl)pyridin-2-amine
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| Structure |
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| Formula |
C20H17ClFN3O2
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| Molecular Weight |
385.826
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| Canonical SMILES |
Cc1cc(F)ccc1CNc1ccc(-c2nc3c(cc2Cl)OCCO3)cn1
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| InChI |
InChI=1S/C20H17ClFN3O2/c1-12-8-15(22)4-2-13(12)10-23-18-5-3-14(11-24-18)19-16(21)9-17-20(25-19)27-7-6-26-17/h2-5,8-9,11H,6-7,10H2,1H3,(H,23,24)
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| InChIKey |
TYLYZQCUXXHCHC-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