General Information of the Compound
| Compound ID |
CP0851363
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| Compound Name |
2-(((trans)-4-(((4-fluorophenyl)(4-(trifluoromethoxy)phenyl)carbamoyloxy)methyl)cyclohexyl)methoxy)acetic acid
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| Formula |
C24H25F4NO6
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| Molecular Weight |
499.457
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| Canonical SMILES |
O=C(O)COC[C@H]1CC[C@H](COC(=O)N(c2ccc(F)cc2)c2ccc(OC(F)(F)F)cc2)CC1
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| InChI |
InChI=1S/C24H25F4NO6/c25-18-5-7-19(8-6-18)29(20-9-11-21(12-10-20)35-24(26,27)28)23(32)34-14-17-3-1-16(2-4-17)13-33-15-22(30)31/h5-12,16-17H,1-4,13-15H2,(H,30,31)/t16-,17-
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| InChIKey |
HAGANSQCTUOPSP-QAQDUYKDSA-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