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canSAR1954746
FEATURES
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NAMES
    SMILES
    Cc1ccc(S(=O)(=O)c2cc3c(=O)n4ccccc4nc3n(CCCN3CCOCC3)c2=N)cc1C
    InChI
    InChI=1S/C26H29N5O4S/c1-18-7-8-20(16-19(18)2)36(33,34)22-17-21-25(28-23-6-3-4-10-30(23)26(21)32)31(24(22)27)11-5-9-29-12-14-35-15-13-29/h3-4,6-8,10,16-17,27H,5,9,11-15H2,1-2H3
    MOLECULAR FORMULA
    C26H29N5O4S
    CROSS REFERENCES
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    canSAR1954746

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 507.19
    AlogP 2.30
    HBond donors 1
    HBond acceptors 9
    Atoms 65
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1954746.