General Information of the Compound
| Compound ID |
CP0388909
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2R)-2-[(5R,8S)-2,5-dimethyl-5,6,7,8-tetrahydroquinolin-8-yl]-N-[2-methyl-3-[4-(trifluoromethoxy)phenyl]phenyl]propanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C28H29F3N2O2
|
||||||||||||||||||
| Molecular Weight |
482.546
|
||||||||||||||||||
| Canonical SMILES |
C[C@H]([C@@H]1CC[C@@H](C)c2ccc(C)nc12)C(=O)Nc1cccc(c1C)-c1ccc(OC(F)(F)F)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C28H29F3N2O2/c1-16-8-14-24(26-22(16)15-9-17(2)32-26)19(4)27(34)33-25-7-5-6-23(18(25)3)20-10-12-21(13-11-20)35-28(29,30)31/h5-7,9-13,15-16,19,24H,8,14H2,1-4H3,(H,33,34)/t16-,19-,24+/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
HKUGMAKDLSHOLT-XKPFWTEKSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound