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canSAR1013707
FEATURES
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NAMES
    SMILES
    CC(C)c1c(OCC(O)CN2CCN(c3ccccc3)CC2)ccc2c1CC[C@H]1C(C)(C)CCC[C@]21C
    InChI
    InChI=1S/C33H48N2O2/c1-24(2)31-27-12-15-30-32(3,4)16-9-17-33(30,5)28(27)13-14-29(31)37-23-26(36)22-34-18-20-35(21-19-34)25-10-7-6-8-11-25/h6-8,10-11,13-14,24,26,30,36H,9,12,15-23H2,1-5H3/t26?,30-,33+/m0/s1
    MOLECULAR FORMULA
    C33H48N2O2
    CROSS REFERENCES
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    canSAR1013707

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.37
    AlogP 6.40
    HBond donors 1
    HBond acceptors 4
    Atoms 85
    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 canSAR1013707.