General Information of the Compound
| Compound ID |
CP0471343
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| Compound Name |
4-cyclopropyl-N-[(S)-(4,4-difluorocyclohexyl)-[7-[[(4S)-2-oxo-4-(trifluoromethyl)imidazolidin-1-yl]methyl]imidazo[1,2-b]pyridazin-2-yl]methyl]-1,2,5-oxadiazole-3-carboxamide
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| Structure |
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| Formula |
C24H25F5N8O3
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| Molecular Weight |
568.507
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| Canonical SMILES |
FC(F)(F)[C@@H]1CN(Cc2cnn3cc(nc3c2)[C@@H](NC(=O)c2nonc2C2CC2)C2CCC(F)(F)CC2)C(=O)N1
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| InChI |
InChI=1S/C24H25F5N8O3/c25-23(26)5-3-14(4-6-23)18(33-21(38)20-19(13-1-2-13)34-40-35-20)15-10-37-17(31-15)7-12(8-30-37)9-36-11-16(24(27,28)29)32-22(36)39/h7-8,10,13-14,16,18H,1-6,9,11H2,(H,32,39)(H,33,38)/t16-,18-/m0/s1
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| InChIKey |
HJIUUSYTQPKKHD-WMZOPIPTSA-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