General Information of the Compound
| Compound ID |
CP0554118
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| Compound Name |
N-[1-(2,5-dichloro-4- pyridyl)azetidin-3-yl]- 7,9-dimethyl- pyrido[3',2':4,5]furo[3,2- d]pyrimidin-4-amine dihydrochloride
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| Structure |
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| Formula |
C19H16Cl2N6O
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| Molecular Weight |
415.284
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| Canonical SMILES |
Cc1cc(C)c2c(n1)oc1c(NC3CN(C3)c3cc(Cl)ncc3Cl)ncnc21
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| InChI |
InChI=1S/C19H16Cl2N6O/c1-9-3-10(2)25-19-15(9)16-17(28-19)18(24-8-23-16)26-11-6-27(7-11)13-4-14(21)22-5-12(13)20/h3-5,8,11H,6-7H2,1-2H3,(H,23,24,26)
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| InChIKey |
GFLVZKRXMPGMCE-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