General Information of the Compound
| Compound ID |
CP0512808
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| Compound Name |
propan-2-yl 4-[6-[4-(azetidine-1-carbonyl)-2,5-difluorophenyl]triazolo[4,5-c]pyridin-3-yl]piperidine-1-carboxylate
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| Structure |
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| Formula |
C24H26F2N6O3
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| Molecular Weight |
484.507
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| Canonical SMILES |
CC(C)OC(=O)N1CCC(CC1)n1nnc2cc(ncc12)-c1cc(F)c(cc1F)C(=O)N1CCC1
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| InChI |
InChI=1S/C24H26F2N6O3/c1-14(2)35-24(34)31-8-4-15(5-9-31)32-22-13-27-20(12-21(22)28-29-32)16-10-19(26)17(11-18(16)25)23(33)30-6-3-7-30/h10-15H,3-9H2,1-2H3
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| InChIKey |
CDOSYWPNMSLQDU-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