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canSAR1534524
FEATURES
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NAMES
    SMILES
    NS(=O)(=O)CCNC(=O)C(c1nc2ccc(-c3cnn(CCN4CCOCC4)c3)cc2s1)S(=O)(=O)Cc1ccc(F)cc1
    InChI
    InChI=1S/C27H31FN6O6S3/c28-22-4-1-19(2-5-22)18-42(36,37)25(26(35)30-7-14-43(29,38)39)27-32-23-6-3-20(15-24(23)41-27)21-16-31-34(17-21)9-8-33-10-12-40-13-11-33/h1-6,15-17,25H,7-14,18H2,(H,30,35)(H2,29,38,39)
    MOLECULAR FORMULA
    C27H31FN6O6S3
    CROSS REFERENCES
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    canSAR1534524

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 650.15
    AlogP 1.69
    HBond donors 3
    HBond acceptors 12
    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 canSAR1534524.