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canSAR1976611
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NAMES
    SMILES
    Cc1cc(=O)oc2c(C)c(OC(C)C(=O)NC[C@H]3CC[C@H](C(=O)O)CC3)ccc12
    InChI
    InChI=1S/C22H27NO6/c1-12-10-19(24)29-20-13(2)18(9-8-17(12)20)28-14(3)21(25)23-11-15-4-6-16(7-5-15)22(26)27/h8-10,14-16H,4-7,11H2,1-3H3,(H,23,25)(H,26,27)/t14?,15-,16-
    MOLECULAR FORMULA
    C22H27NO6
    CROSS REFERENCES
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    canSAR1976611

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 401.18
    AlogP 3.18
    HBond donors 2
    HBond acceptors 7
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1976611.