General Information of the Compound
| Compound ID |
CP0868521
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| Compound Name |
(R)-N-(1-(4-(8-Methoxy-6-(pyridin-4-yl)quinazolin-2-ylamino)phenyl)ethyl)acetamide
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| Structure |
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| Formula |
C24H23N5O2
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| Molecular Weight |
413.481
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| Canonical SMILES |
COc1cc(-c2ccncc2)cc2cnc(Nc3ccc([C@@H](C)NC(C)=O)cc3)nc12
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| InChI |
InChI=1S/C24H23N5O2/c1-15(27-16(2)30)17-4-6-21(7-5-17)28-24-26-14-20-12-19(18-8-10-25-11-9-18)13-22(31-3)23(20)29-24/h4-15H,1-3H3,(H,27,30)(H,26,28,29)/t15-/m1/s1
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| InChIKey |
VTMWOMKMTOKMTQ-OAHLLOKOSA-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