General Information of the Compound
| Compound ID |
CP0368691
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| Compound Name |
1-ethyl-3-methoxy-N-[6-(4-propan-2-yl-1,2,4-triazol-3-yl)pyridin-2-yl]pyrazole-4-carboxamide
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| Structure |
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| Formula |
C17H21N7O2
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| Molecular Weight |
355.402
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| Canonical SMILES |
CCn1cc(C(=O)Nc2cccc(n2)-c2nncn2C(C)C)c(OC)n1
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| InChI |
InChI=1S/C17H21N7O2/c1-5-23-9-12(17(22-23)26-4)16(25)20-14-8-6-7-13(19-14)15-21-18-10-24(15)11(2)3/h6-11H,5H2,1-4H3,(H,19,20,25)
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| InChIKey |
UGAQYDMHQFTUBE-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