General Information of the Compound
| Compound ID |
CP0373569
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| Compound Name |
7-[(3,5-dimethoxyphenyl)amino]-5-{[(1R)-1-phenylethyl]amino}imidazo[1,2-a]pyrimidine-8-carboxamide
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| Structure |
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| Formula |
C23H24N6O3
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| Molecular Weight |
432.484
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| Canonical SMILES |
COc1cc(Nc2nc(N[C@H](C)c3ccccc3)n3ccnc3c2C(N)=O)cc(OC)c1
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| InChI |
InChI=1S/C23H24N6O3/c1-14(15-7-5-4-6-8-15)26-23-28-21(19(20(24)30)22-25-9-10-29(22)23)27-16-11-17(31-2)13-18(12-16)32-3/h4-14,27H,1-3H3,(H2,24,30)(H,26,28)/t14-/m1/s1
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| InChIKey |
CSNAGRSJQPKGQQ-CQSZACIVSA-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: PT02470, Lysine--tRNA ligase
Protein ID: PT00846, Tyrosine-protein kinase ZAP-70