General Information of the Compound
| Compound ID |
CP0894723
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| Compound Name |
N,N-Dimethyl-N'-{4-[(6-pyridin-4-ylquinazolin-2-yl)amino]-benzyl}ethane-1,2-diamine
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| Structure |
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| Formula |
C24H26N6
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| Molecular Weight |
398.514
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| Canonical SMILES |
CN(C)CCNCc1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1
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| InChI |
InChI=1S/C24H26N6/c1-30(2)14-13-26-16-18-3-6-22(7-4-18)28-24-27-17-21-15-20(5-8-23(21)29-24)19-9-11-25-12-10-19/h3-12,15,17,26H,13-14,16H2,1-2H3,(H,27,28,29)
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| InChIKey |
IHNDVQAJDJUVJJ-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