General Information of the Compound
| Compound ID |
CP0573985
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| Compound Name |
propan-2-yl 4-[6-[4-(ethylcarbamoyl)-2,5-difluorophenyl]triazolo[4,5-c]pyridin-3-yl]piperidine-1-carboxylate
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| Structure |
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| Formula |
C23H26F2N6O3
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| Molecular Weight |
472.496
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| Canonical SMILES |
CCNC(=O)c1cc(F)c(cc1F)-c1cc2nnn(C3CCN(CC3)C(=O)OC(C)C)c2cn1
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| InChI |
InChI=1S/C23H26F2N6O3/c1-4-26-22(32)16-10-17(24)15(9-18(16)25)19-11-20-21(12-27-19)31(29-28-20)14-5-7-30(8-6-14)23(33)34-13(2)3/h9-14H,4-8H2,1-3H3,(H,26,32)
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| InChIKey |
QZABTGQGTRSJPG-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