General Information of the Compound
| Compound ID |
CP0385692
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| Compound Name |
US8895592, 34
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| Formula |
C24H32F3N3O3S
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| Molecular Weight |
499.599
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| Canonical SMILES |
CCCCn1c(C(=O)OC)c(s\c1=N/C(=O)c1cc(ccc1NC(C)(C)C)C(F)(F)F)C(C)C
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| InChI |
InChI=1S/C24H32F3N3O3S/c1-8-9-12-30-18(21(32)33-7)19(14(2)3)34-22(30)28-20(31)16-13-15(24(25,26)27)10-11-17(16)29-23(4,5)6/h10-11,13-14,29H,8-9,12H2,1-7H3/b28-22-
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| InChIKey |
UUEUIJGARHTZOL-SLMZUGIISA-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
Protein ID: PT02333, Cannabinoid receptor 2
Protein ID: PT00834, Cannabinoid receptor 2