140534 logo
canSAR140534
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CS(=O)(=O)Nc1cccc(OCC(O)CN2CCC(c3ccccc3)CC2)c1
    InChI
    InChI=1S/C21H28N2O4S/c1-28(25,26)22-19-8-5-9-21(14-19)27-16-20(24)15-23-12-10-18(11-13-23)17-6-3-2-4-7-17/h2-9,14,18,20,22,24H,10-13,15-16H2,1H3
    MOLECULAR FORMULA
    C21H28N2O4S
    CROSS REFERENCES
    140534 logo

    canSAR140534

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.18
    AlogP 2.68
    HBond donors 2
    HBond acceptors 6
    Atoms 56
    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 canSAR140534.