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canSAR1094653
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NAMES
    SMILES
    CCCCCc1ccc(-c2cc3cn([C@@H]4CC[C@H](CO)O4)c(=O)nc3o2)cc1
    InChI
    InChI=1S/C22H26N2O4/c1-2-3-4-5-15-6-8-16(9-7-15)19-12-17-13-24(22(26)23-21(17)28-19)20-11-10-18(14-25)27-20/h6-9,12-13,18,20,25H,2-5,10-11,14H2,1H3/t18-,20+/m1/s1
    MOLECULAR FORMULA
    C22H26N2O4
    CROSS REFERENCES
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    canSAR1094653

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 382.19
    AlogP 4.06
    HBond donors 1
    HBond acceptors 6
    Atoms 54
    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 canSAR1094653.