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canSAR499813
FEATURES
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NAMES
    SMILES
    O=C(O)C[C@H](NC(=O)C(c1ccccn1)n1cccc(NC(=O)c2ccc3ccccc3c2)c1=O)C(=O)COc1ccccc1
    InChI
    InChI=1S/C34H28N4O7/c39-29(21-45-25-11-2-1-3-12-25)28(20-30(40)41)37-33(43)31(26-13-6-7-17-35-26)38-18-8-14-27(34(38)44)36-32(42)24-16-15-22-9-4-5-10-23(22)19-24/h1-19,28,31H,20-21H2,(H,36,42)(H,37,43)(H,40,41)/t28-,31?/m0/s1
    MOLECULAR FORMULA
    C34H28N4O7
    CROSS REFERENCES
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    canSAR499813

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 604.20
    AlogP 3.85
    HBond donors 3
    HBond acceptors 11
    Atoms 73
    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 canSAR499813.