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canSAR990442
FEATURES
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NAMES
    SMILES
    CC(C)CCc1c(OCCCCCCCC(=O)NO)ccc2ccc(=O)oc12
    InChI
    InChI=1S/C22H31NO5/c1-16(2)9-12-18-19(13-10-17-11-14-21(25)28-22(17)18)27-15-7-5-3-4-6-8-20(24)23-26/h10-11,13-14,16,26H,3-9,12,15H2,1-2H3,(H,23,24)
    MOLECULAR FORMULA
    C22H31NO5
    CROSS REFERENCES
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    canSAR990442

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.22
    AlogP 4.61
    HBond donors 2
    HBond acceptors 6
    Atoms 59
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR990442.