General Information of the Compound
| Compound ID |
CP0751114
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| Compound Name |
3-Methoxy-N-(4-(6-(pyridin-4-yl)quinazolin-2-ylamino)-phenyl)propanamide
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| Structure |
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| Formula |
C23H21N5O2
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| Molecular Weight |
399.454
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| Canonical SMILES |
COCCC(=O)Nc1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C23H21N5O2/c1-30-13-10-22(29)26-19-3-5-20(6-4-19)27-23-25-15-18-14-17(2-7-21(18)28-23)16-8-11-24-12-9-16/h2-9,11-12,14-15H,10,13H2,1H3,(H,26,29)(H,25,27,28)
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| InChIKey |
MCKPLODGBCOICL-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