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canSAR1145816
FEATURES
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NAMES
    SMILES
    O=c1c(CCC(O)c2ccc(Cl)cc2)coc2cccc(OCC3CCCCC3)c12
    InChI
    InChI=1S/C25H27ClO4/c26-20-12-9-18(10-13-20)21(27)14-11-19-16-30-23-8-4-7-22(24(23)25(19)28)29-15-17-5-2-1-3-6-17/h4,7-10,12-13,16-17,21,27H,1-3,5-6,11,14-15H2
    MOLECULAR FORMULA
    C25H27ClO4
    CROSS REFERENCES
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    canSAR1145816

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 426.16
    AlogP 6.07
    HBond donors 1
    HBond acceptors 4
    Atoms 57
    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 canSAR1145816.