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canSAR1518364
FEATURES
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NAMES
    SMILES
    COc1ccc(CCNC(=O)c2cccnc2Oc2ccc(Nc3nc4ccccc4s3)cc2)cc1
    InChI
    InChI=1S/C28H24N4O3S/c1-34-21-12-8-19(9-13-21)16-18-29-26(33)23-5-4-17-30-27(23)35-22-14-10-20(11-15-22)31-28-32-24-6-2-3-7-25(24)36-28/h2-15,17H,16,18H2,1H3,(H,29,33)(H,31,32)
    MOLECULAR FORMULA
    C28H24N4O3S
    CROSS REFERENCES
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    canSAR1518364

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.16
    AlogP 6.21
    HBond donors 2
    HBond acceptors 7
    Atoms 60
    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 canSAR1518364.