General Information of the Compound
| Compound ID |
CP0428606
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| Compound Name |
7-(2,6-dimethylphenyl)-4-(4-methylpiperazin-1-yl)quinazolin-2-amine
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| Structure |
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| Formula |
C21H25N5
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| Molecular Weight |
347.466
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| Canonical SMILES |
CN1CCN(CC1)c1nc(N)nc2cc(ccc12)-c1c(C)cccc1C
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| InChI |
InChI=1S/C21H25N5/c1-14-5-4-6-15(2)19(14)16-7-8-17-18(13-16)23-21(22)24-20(17)26-11-9-25(3)10-12-26/h4-8,13H,9-12H2,1-3H3,(H2,22,23,24)
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| InChIKey |
JYNVTOGGFAIUOG-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