2096818 logo
canSAR2096818
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=S(=O)(Cc1ccccc1)N(Cc1ccco1)CC(O)Cn1c2ccccc2c2ccccc21
    InChI
    InChI=1S/C27H26N2O4S/c30-22(18-29-26-14-6-4-12-24(26)25-13-5-7-15-27(25)29)17-28(19-23-11-8-16-33-23)34(31,32)20-21-9-2-1-3-10-21/h1-16,22,30H,17-20H2
    MOLECULAR FORMULA
    C27H26N2O4S
    CROSS REFERENCES
    2096818 logo

    canSAR2096818

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 474.16
    AlogP 4.78
    HBond donors 1
    HBond acceptors 6
    Atoms 60
    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 canSAR2096818.