General Information of the Compound
| Compound ID |
CP0142384
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| Compound Name |
CHEMBL2322345
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| Formula |
C18H18Cl2N4O2
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| Molecular Weight |
393.274
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| Canonical SMILES |
Nc1nn2c(O)cc(nc2c1Cc1cccc(Cl)c1Cl)C1CCOCC1
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| InChI |
InChI=1S/C18H18Cl2N4O2/c19-13-3-1-2-11(16(13)20)8-12-17(21)23-24-15(25)9-14(22-18(12)24)10-4-6-26-7-5-10/h1-3,9-10,25H,4-8H2,(H2,21,23)
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| InChIKey |
CSRHZFVAVRTASU-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: PT01033, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform