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canSAR1984909
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NAMES
    SMILES
    CC(=O)[C@@]1(C)CC[C@H]2[C@@H](C=CC3=CC(=O)CC[C@@]32C)[C@@H]1CC#N
    InChI
    InChI=1S/C20H25NO2/c1-13(22)19(2)10-7-17-16(18(19)8-11-21)5-4-14-12-15(23)6-9-20(14,17)3/h4-5,12,16-18H,6-10H2,1-3H3/t16-,17+,18+,19-,20+/m1/s1
    MOLECULAR FORMULA
    C20H25NO2
    CROSS REFERENCES
    1984909 logo

    canSAR1984909

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 311.19
    AlogP 4.00
    HBond donors 0
    HBond acceptors 3
    Atoms 48
    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 canSAR1984909.