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canSAR1065139
FEATURES
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NAMES
    SMILES
    Cc1cc2c(c(=O)o1)C=C1CC[C@H](C(C)CNCc3ccc(C#N)cc3)C[C@@H]1O2
    InChI
    InChI=1S/C24H26N2O3/c1-15(13-26-14-18-5-3-17(12-25)4-6-18)19-7-8-20-10-21-23(29-22(20)11-19)9-16(2)28-24(21)27/h3-6,9-10,15,19,22,26H,7-8,11,13-14H2,1-2H3/t15?,19-,22-/m0/s1
    MOLECULAR FORMULA
    C24H26N2O3
    CROSS REFERENCES
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    canSAR1065139

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 390.19
    AlogP 4.19
    HBond donors 1
    HBond acceptors 5
    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 canSAR1065139.