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canSAR1999965
FEATURES
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NAMES
    SMILES
    CC(NC(=O)[C@@H](NC(=O)c1ccc2ncccc2c1)C(C)C)C(=O)CNC(=O)Cc1cccc(-c2ccccn2)c1
    InChI
    InChI=1S/C32H33N5O4/c1-20(2)30(37-31(40)25-12-13-27-24(18-25)10-7-15-34-27)32(41)36-21(3)28(38)19-35-29(39)17-22-8-6-9-23(16-22)26-11-4-5-14-33-26/h4-16,18,20-21,30H,17,19H2,1-3H3,(H,35,39)(H,36,41)(H,37,40)/t21?,30-/m0/s1
    MOLECULAR FORMULA
    C32H33N5O4
    CROSS REFERENCES
    1999965 logo

    canSAR1999965

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 551.25
    AlogP 3.48
    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 canSAR1999965.