General Information of the Compound
| Compound ID |
CP0898128
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| Compound Name |
N-(1-(4-(6-(Pyridin-4-yl)quinazolin-2-ylamino)phenyl)ethyl)-acetamide
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| Structure |
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| Formula |
C23H21N5O
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| Molecular Weight |
383.455
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| Canonical SMILES |
CC(=O)NC(C)c1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C23H21N5O/c1-15(26-16(2)29)17-3-6-21(7-4-17)27-23-25-14-20-13-19(5-8-22(20)28-23)18-9-11-24-12-10-18/h3-15H,1-2H3,(H,26,29)(H,25,27,28)
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| InChIKey |
FSHWAYWSRSSJNF-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