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canSAR1859821
FEATURES
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NAMES
    SMILES
    CCCn1cc(-c2ccc([C@H](C)N3CC[C@](CC(C)(C)O)(c4ccccc4)OC3=O)cc2)ccc1=O
    InChI
    InChI=1S/C30H36N2O4/c1-5-18-31-20-25(15-16-27(31)33)24-13-11-23(12-14-24)22(2)32-19-17-30(36-28(32)34,21-29(3,4)35)26-9-7-6-8-10-26/h6-16,20,22,35H,5,17-19,21H2,1-4H3/t22-,30-/m0/s1
    MOLECULAR FORMULA
    C30H36N2O4
    CROSS REFERENCES
    1859821 logo

    canSAR1859821

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 488.27
    AlogP 5.89
    HBond donors 1
    HBond acceptors 6
    Atoms 72
    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 canSAR1859821.