General Information of the Compound
| Compound ID |
CP0489409
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| Compound Name |
4-N-[2-[(2-amino-6-phenylpyrimidin-4-yl)amino]ethyl]-6-phenylpyrimidine-2,4-diamine
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| Structure |
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| Formula |
C22H22N8
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| Molecular Weight |
398.474
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| Canonical SMILES |
Nc1nc(NCCNc2cc(nc(N)n2)-c2ccccc2)cc(n1)-c1ccccc1
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| InChI |
InChI=1S/C22H22N8/c23-21-27-17(15-7-3-1-4-8-15)13-19(29-21)25-11-12-26-20-14-18(28-22(24)30-20)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H3,23,25,27,29)(H3,24,26,28,30)
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| InChIKey |
DVXYUXLHTDGETF-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