General Information of the Compound
Compound ID |
CP0399394
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
(S)-N-(5-(3-(bis(4-(difluoromethoxy)phenyl)methylamino)-2-hydroxypropyl)-2-hydroxyphenyl)methanesulfonamide
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C25H26F4N2O6S
|
||||||||||||||||||
Molecular Weight |
558.55
|
||||||||||||||||||
Canonical SMILES |
CS(=O)(=O)Nc1cc(C[C@H](O)CNC(c2ccc(OC(F)F)cc2)c2ccc(OC(F)F)cc2)ccc1O
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C25H26F4N2O6S/c1-38(34,35)31-21-13-15(2-11-22(21)33)12-18(32)14-30-23(16-3-7-19(8-4-16)36-24(26)27)17-5-9-20(10-6-17)37-25(28)29/h2-11,13,18,23-25,30-33H,12,14H2,1H3/t18-/m0/s1
Show/Hide
|
||||||||||||||||||
InChIKey |
WNASSUBAOGLYFA-SFHVURJKSA-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