canSAR742099
FEATURES
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NAMES
    SMILES
    Cl.NCc1cc(-c2ccc(/C=C/C(=O)O)cc2)cc(C23CC4CC(CC(C4)C2)C3)c1O
    InChI
    InChI=1S/C26H29NO3.ClH/c27-15-22-10-21(20-4-1-16(2-5-20)3-6-24(28)29)11-23(25(22)30)26-12-17-7-18(13-26)9-19(8-17)14-26;/h1-6,10-11,17-19,30H,7-9,12-15,27H2,(H,28,29);1H/b6-3+;
    MOLECULAR FORMULA
    C26H30ClNO3
    CROSS REFERENCES
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    canSAR742099
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight439.19
    AlogP5.51
    HBond donors4
    HBond acceptors4
    Atoms61
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR742099.