General Information of the Compound
| Compound ID |
CP0512860
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| Compound Name |
2-methoxy-N-[2-(4-methoxyphenyl)ethyl]-6-[(2-methoxyphenyl)methoxy]pyrimidin-4-amine
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| Structure |
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| Formula |
C22H25N3O4
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| Molecular Weight |
395.459
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| Canonical SMILES |
COc1ccc(CCNc2cc(OCc3ccccc3OC)nc(OC)n2)cc1
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| InChI |
InChI=1S/C22H25N3O4/c1-26-18-10-8-16(9-11-18)12-13-23-20-14-21(25-22(24-20)28-3)29-15-17-6-4-5-7-19(17)27-2/h4-11,14H,12-13,15H2,1-3H3,(H,23,24,25)
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| InChIKey |
HIXLPEPAQPRNNN-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