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canSAR1766810
FEATURES
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NAMES
    SMILES
    COc1ccc(C2Nc3ccc(NC(C)=O)cc3C(=O)N2Cc2cccc(Cl)c2)cc1COc1ccc(NC(C)=O)cc1
    InChI
    InChI=1S/C33H31ClN4O5/c1-20(39)35-26-8-11-28(12-9-26)43-19-24-16-23(7-14-31(24)42-3)32-37-30-13-10-27(36-21(2)40)17-29(30)33(41)38(32)18-22-5-4-6-25(34)15-22/h4-17,32,37H,18-19H2,1-3H3,(H,35,39)(H,36,40)
    MOLECULAR FORMULA
    C33H31ClN4O5
    CROSS REFERENCES
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    canSAR1766810

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 598.20
    AlogP 6.61
    HBond donors 3
    HBond acceptors 9
    Atoms 74
    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 canSAR1766810.