General Information of the Compound
| Compound ID |
CP0401281
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| Compound Name |
pyridin-4-yl-[9-[[2-(1,1,2,2-tetrafluoroethoxy)phenyl]methyl]-3,9-diazaspiro[5.5]undecan-3-yl]methanone
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| Structure |
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| Formula |
C24H27F4N3O2
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| Molecular Weight |
465.491
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| Canonical SMILES |
FC(F)C(F)(F)Oc1ccccc1CN1CCC2(CC1)CCN(CC2)C(=O)c1ccncc1
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| InChI |
InChI=1S/C24H27F4N3O2/c25-22(26)24(27,28)33-20-4-2-1-3-19(20)17-30-13-7-23(8-14-30)9-15-31(16-10-23)21(32)18-5-11-29-12-6-18/h1-6,11-12,22H,7-10,13-17H2
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| InChIKey |
ZQYTURKIACTXPU-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