General Information of the Compound
| Compound ID |
CP0838670
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| Compound Name |
(R)-3-((6-(2-Ethoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)-3-phenylpropan-1-ol
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| Formula |
C23H24N4O2
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| Molecular Weight |
388.471
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| Canonical SMILES |
CCOc1ccccc1-c1cc2c(N[C@H](CCO)c3ccccc3)ncnc2[nH]1
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| InChI |
InChI=1S/C23H24N4O2/c1-2-29-21-11-7-6-10-17(21)20-14-18-22(24-15-25-23(18)27-20)26-19(12-13-28)16-8-4-3-5-9-16/h3-11,14-15,19,28H,2,12-13H2,1H3,(H2,24,25,26,27)/t19-/m1/s1
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| InChIKey |
VDHVVAUPCWEMMS-LJQANCHMSA-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