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canSAR1066485
FEATURES
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NAMES
    SMILES
    O=C(Nc1cc(-c2ccncc2)c[nH]c1=O)[C@H](Cc1ccccc1)NCC1CCS(=O)(=O)CC1
    InChI
    InChI=1S/C25H28N4O4S/c30-24-23(15-21(17-28-24)20-6-10-26-11-7-20)29-25(31)22(14-18-4-2-1-3-5-18)27-16-19-8-12-34(32,33)13-9-19/h1-7,10-11,15,17,19,22,27H,8-9,12-14,16H2,(H,28,30)(H,29,31)/t22-/m0/s1
    MOLECULAR FORMULA
    C25H28N4O4S
    CROSS REFERENCES
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    canSAR1066485

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.18
    AlogP 2.40
    HBond donors 3
    HBond acceptors 8
    Atoms 62
    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 canSAR1066485.