General Information of the Compound
| Compound ID |
CP0382669
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| Compound Name |
N-cycloheptyl-N-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
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| Structure |
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| Formula |
C14H20N4
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| Molecular Weight |
244.342
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| Canonical SMILES |
CN(C1CCCCCC1)c1ncnc2[nH]ccc12
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| InChI |
InChI=1S/C14H20N4/c1-18(11-6-4-2-3-5-7-11)14-12-8-9-15-13(12)16-10-17-14/h8-11H,2-7H2,1H3,(H,15,16,17)
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| InChIKey |
LMWSFHNYYHRQTO-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: PT01659, Tyrosine-protein kinase JAK1
Protein ID: PT00892, Tyrosine-protein kinase JAK3