canSAR948870
FEATURES
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NAMES
    SMILES
    Cc1ccccc1/C=C1\CCCC2=C1OC(N)=C(c1nc(-c3ccccc3)no1)C2c1ccccc1C
    InChI
    InChI=1S/C32H29N3O2/c1-20-11-6-8-15-23(20)19-24-16-10-18-26-27(25-17-9-7-12-21(25)2)28(30(33)36-29(24)26)32-34-31(35-37-32)22-13-4-3-5-14-22/h3-9,11-15,17,19,27H,10,16,18,33H2,1-2H3/b24-19+
    MOLECULAR FORMULA
    C32H29N3O2
    CROSS REFERENCES
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    canSAR948870
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight487.23
    AlogP7.32
    HBond donors2
    HBond acceptors5
    Atoms66
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR948870.