General Information of the Compound
| Compound ID |
CP0233949
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| Compound Name |
(4-anilino-6-methyl-pyrimidin-2-yl)-benzyl-amine
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| Structure |
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| Formula |
C18H18N4
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| Molecular Weight |
290.37
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| Canonical SMILES |
Cc1cc(Nc2ccccc2)nc(NCc2ccccc2)n1
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| InChI |
InChI=1S/C18H18N4/c1-14-12-17(21-16-10-6-3-7-11-16)22-18(20-14)19-13-15-8-4-2-5-9-15/h2-12H,13H2,1H3,(H2,19,20,21,22)
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| InChIKey |
JBMDCMXLJQREND-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06172, Mothers against decapentaplegic homolog 3