General Information of the Compound
| Compound ID |
CP0067046
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| Compound Name |
2-(3-ethylphenoxy)-N-propan-2-yl-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide
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| Structure |
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| Formula |
C18H20N4O2
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| Molecular Weight |
324.384
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| Canonical SMILES |
CCc1cccc(Oc2cnc3[nH]cc(C(=O)NC(C)C)c3n2)c1
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| InChI |
InChI=1S/C18H20N4O2/c1-4-12-6-5-7-13(8-12)24-15-10-20-17-16(22-15)14(9-19-17)18(23)21-11(2)3/h5-11H,4H2,1-3H3,(H,19,20)(H,21,23)
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| InChIKey |
IUHHPKRKDSGDFI-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