General Information of the Compound
| Compound ID |
CP0176880
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| Compound Name |
3-methoxy-1-methyl-N-[6-[4-[1-(trifluoromethyl)cyclopropyl]-1,2,4-triazol-3-yl]pyridin-2-yl]pyrazole-4-carboxamide
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| Structure |
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| Formula |
C17H16F3N7O2
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| Molecular Weight |
407.356
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| Canonical SMILES |
COc1nn(C)cc1C(=O)Nc1cccc(n1)-c1nncn1C1(CC1)C(F)(F)F
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| InChI |
InChI=1S/C17H16F3N7O2/c1-26-8-10(15(25-26)29-2)14(28)23-12-5-3-4-11(22-12)13-24-21-9-27(13)16(6-7-16)17(18,19)20/h3-5,8-9H,6-7H2,1-2H3,(H,22,23,28)
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| InChIKey |
YRADBYWOOKSYIL-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