General Information of the Compound
| Compound ID |
CP0393135
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| Compound Name |
N-[3-[[2-(3-cyanophenyl)quinazolin-4-yl]amino]phenyl]acetamide
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| Structure |
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| Formula |
C23H17N5O
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| Molecular Weight |
379.423
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| Canonical SMILES |
CC(=O)Nc1cccc(Nc2nc(nc3ccccc23)-c2cccc(c2)C#N)c1
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| InChI |
InChI=1S/C23H17N5O/c1-15(29)25-18-8-5-9-19(13-18)26-23-20-10-2-3-11-21(20)27-22(28-23)17-7-4-6-16(12-17)14-24/h2-13H,1H3,(H,25,29)(H,26,27,28)
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| InChIKey |
JIRDXCUNCYNNBP-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