General Information of the Compound
| Compound ID |
CP0406658
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| Compound Name |
6-Benzyl-5-(3-bromo-phenyl)-7-(6-morpholin-4-yl-pyridin-3-yl)-pyrido[2,3-d]pyrimidin-4-ylamine
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| Structure |
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| Formula |
C29H25BrN6O
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| Molecular Weight |
553.464
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| Canonical SMILES |
Nc1ncnc2nc(-c3ccc(nc3)N3CCOCC3)c(Cc3ccccc3)c(-c3cccc(Br)c3)c12
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| InChI |
InChI=1S/C29H25BrN6O/c30-22-8-4-7-20(16-22)25-23(15-19-5-2-1-3-6-19)27(35-29-26(25)28(31)33-18-34-29)21-9-10-24(32-17-21)36-11-13-37-14-12-36/h1-10,16-18H,11-15H2,(H2,31,33,34,35)
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| InChIKey |
WGAXWNJGYOYHAU-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