833987 logo
canSAR833987
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCC(Sc1ccc(OCCCOc2cccc(C)c2C)cc1)C(=O)O
    InChI
    InChI=1S/C23H30O4S/c1-4-5-10-22(23(24)25)28-20-13-11-19(12-14-20)26-15-7-16-27-21-9-6-8-17(2)18(21)3/h6,8-9,11-14,22H,4-5,7,10,15-16H2,1-3H3,(H,24,25)
    MOLECULAR FORMULA
    C23H30O4S
    CROSS REFERENCES
    833987 logo

    canSAR833987

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.19
    AlogP 5.89
    HBond donors 1
    HBond acceptors 4
    Atoms 58
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR833987.