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canSAR645554
FEATURES
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NAMES
    SMILES
    Br.NCCCNC(=O)c1csc(NC(=O)c2csc(NC(=O)CCCN)n2)n1
    InChI
    InChI=1S/C15H21N7O3S2.BrH/c16-4-1-3-11(23)21-14-20-10(8-26-14)13(25)22-15-19-9(7-27-15)12(24)18-6-2-5-17;/h7-8H,1-6,16-17H2,(H,18,24)(H,19,22,25)(H,20,21,23);1H
    MOLECULAR FORMULA
    C15H22BrN7O3S2
    CROSS REFERENCES
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    canSAR645554

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.04
    AlogP 1.19
    HBond donors 7
    HBond acceptors 10
    Atoms 50
    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 canSAR645554.