General Information of the Compound
| Compound ID |
CP0383540
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| Compound Name |
N,2-bis(3-methoxyphenyl)quinazolin-4-amine
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| Structure |
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| Formula |
C22H19N3O2
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| Molecular Weight |
357.413
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| Canonical SMILES |
COc1cccc(Nc2nc(nc3ccccc23)-c2cccc(OC)c2)c1
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| InChI |
InChI=1S/C22H19N3O2/c1-26-17-9-5-7-15(13-17)21-24-20-12-4-3-11-19(20)22(25-21)23-16-8-6-10-18(14-16)27-2/h3-14H,1-2H3,(H,23,24,25)
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| InChIKey |
NQCVYTWHAXYWQY-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