831581 logo
4'-(Butylthio)Avarone
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
  • 4'-(Butylthio)Avarone
SMILES
CCCCSC1=CC(=O)C(C[C@]2(C)[C@@H](C)CC[C@]3(C)C(C)=CCC[C@H]32)=CC1=O
InChI
InChI=1S/C25H36O2S/c1-6-7-13-28-22-15-20(26)19(14-21(22)27)16-25(5)18(3)11-12-24(4)17(2)9-8-10-23(24)25/h9,14-15,18,23H,6-8,10-13,16H2,1-5H3/t18-,23+,24+,25+/m0/s1
MOLECULAR FORMULA
C25H36O2S
CROSS REFERENCES
831581 logo

4'-(Butylthio)Avarone

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 400.24
AlogP 6.67
HBond donors 0
HBond acceptors 2
Atoms 64
Contains toxicophore Yes
Contains PAINS Yes
Commercially available Unknown
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by 4'-(Butylthio)Avarone.