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canSAR934603
FEATURES
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NAMES
    SMILES
    C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CC(CC(=O)NCc1ccccn1)C2=O
    InChI
    InChI=1S/C26H30N2O3/c1-26-10-9-21-20-8-6-19(29)12-16(20)5-7-22(21)23(26)13-17(25(26)31)14-24(30)28-15-18-4-2-3-11-27-18/h2-4,6,8,11-12,17,21-23,29H,5,7,9-10,13-15H2,1H3,(H,28,30)/t17?,21-,22-,23+,26+/m1/s1
    MOLECULAR FORMULA
    C26H30N2O3
    CROSS REFERENCES
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    canSAR934603

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 418.23
    AlogP 4.14
    HBond donors 2
    HBond acceptors 5
    Atoms 61
    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 canSAR934603.