General Information of the Compound
| Compound ID |
CP0388006
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| Compound Name |
N,2-bis(3,4-dimethoxyphenyl)quinazolin-4-amine
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| Structure |
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| Formula |
C24H23N3O4
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| Molecular Weight |
417.465
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| Canonical SMILES |
COc1ccc(Nc2nc(nc3ccccc23)-c2ccc(OC)c(OC)c2)cc1OC
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| InChI |
InChI=1S/C24H23N3O4/c1-28-19-11-9-15(13-21(19)30-3)23-26-18-8-6-5-7-17(18)24(27-23)25-16-10-12-20(29-2)22(14-16)31-4/h5-14H,1-4H3,(H,25,26,27)
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| InChIKey |
NPEXIJINZNZJDD-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
Protein ID: PT01546, ATP-dependent translocase ABCB1
Protein ID: PT02718, Broad substrate specificity ATP-binding cassette transporter ABCG2
Protein ID: PT02516, Multidrug resistance-associated protein 1