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canSAR788756
FEATURES
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NAMES
    SMILES
    C[C@]12C=CC(=O)N[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@]21CCCO1
    InChI
    InChI=1S/C21H31NO2/c1-19-10-8-18(23)22-17(19)5-4-14-15(19)6-11-20(2)16(14)7-12-21(20)9-3-13-24-21/h8,10,14-17H,3-7,9,11-13H2,1-2H3,(H,22,23)/t14-,15+,16+,17-,19-,20+,21+/m1/s1
    MOLECULAR FORMULA
    C21H31NO2
    CROSS REFERENCES
    788756 logo

    canSAR788756

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.24
    AlogP 3.83
    HBond donors 1
    HBond acceptors 3
    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 canSAR788756.