General Information of the Compound
| Compound ID |
CP0534062
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| Compound Name |
3-methoxy-N-[6-[4-[(2S)-1-methoxypropan-2-yl]-1,2,4-triazol-3-yl]pyridin-2-yl]-1-methylpyrazole-4-carboxamide
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| Structure |
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| Formula |
C17H21N7O3
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| Molecular Weight |
371.401
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| Canonical SMILES |
COC[C@H](C)n1cnnc1-c1cccc(NC(=O)c2cn(C)nc2OC)n1
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| InChI |
InChI=1S/C17H21N7O3/c1-11(9-26-3)24-10-18-21-15(24)13-6-5-7-14(19-13)20-16(25)12-8-23(2)22-17(12)27-4/h5-8,10-11H,9H2,1-4H3,(H,19,20,25)/t11-/m0/s1
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| InChIKey |
ATCOLITULJJMES-NSHDSACASA-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