canSAR1773520
FEATURES
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NAMES
    SMILES
    Cc1cc(OC2CC2)ccc1N1CCC(Oc2ccc([C@H](C)NC(=O)N3CCOCC3)cc2)C1
    InChI
    InChI=1S/C27H35N3O4/c1-19-17-24(33-23-7-8-23)9-10-26(19)30-12-11-25(18-30)34-22-5-3-21(4-6-22)20(2)28-27(31)29-13-15-32-16-14-29/h3-6,9-10,17,20,23,25H,7-8,11-16,18H2,1-2H3,(H,28,31)/t20-,25?/m0/s1
    MOLECULAR FORMULA
    C27H35N3O4
    CROSS REFERENCES
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    canSAR1773520
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight465.26
    AlogP4.30
    HBond donors1
    HBond acceptors7
    Atoms69
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1773520.