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canSAR502973
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NAMES
    SMILES
    CC1(C)CCC(C)(C)c2cc(C3CC(c4ccc(C(=O)O)cc4)=NO3)ccc21
    InChI
    InChI=1S/C24H27NO3/c1-23(2)11-12-24(3,4)19-13-17(9-10-18(19)23)21-14-20(25-28-21)15-5-7-16(8-6-15)22(26)27/h5-10,13,21H,11-12,14H2,1-4H3,(H,26,27)
    MOLECULAR FORMULA
    C24H27NO3
    CROSS REFERENCES
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    canSAR502973

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 377.20
    AlogP 5.60
    HBond donors 1
    HBond acceptors 4
    Atoms 55
    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 canSAR502973.