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canSAR784254
FEATURES
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NAMES
    SMILES
    C[C@]12CC[C@H](O)C[C@H]1CCC1C2CC[C@]2(C)[C@@H](/C=N/Nc3ccccn3)CC[C@]12O
    InChI
    InChI=1S/C25H37N3O2/c1-23-11-9-19(29)15-17(23)6-7-21-20(23)10-12-24(2)18(8-13-25(21,24)30)16-27-28-22-5-3-4-14-26-22/h3-5,14,16-21,29-30H,6-13,15H2,1-2H3,(H,26,28)/b27-16+/t17-,18-,19+,20?,21?,23+,24-,25+/m1/s1
    MOLECULAR FORMULA
    C25H37N3O2
    CROSS REFERENCES
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    canSAR784254

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.29
    AlogP 4.61
    HBond donors 3
    HBond acceptors 5
    Atoms 67
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR784254.