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canSAR657897
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NAMES
    SMILES
    Clc1ccc2c(NCCNc3nc(NCCN4CCOCC4)nc(N4CCOCC4)n3)ccnc2c1
    InChI
    InChI=1S/C24H32ClN9O2/c25-18-1-2-19-20(3-4-26-21(19)17-18)27-5-6-28-22-30-23(29-7-8-33-9-13-35-14-10-33)32-24(31-22)34-11-15-36-16-12-34/h1-4,17H,5-16H2,(H,26,27)(H2,28,29,30,31,32)
    MOLECULAR FORMULA
    C24H32ClN9O2
    CROSS REFERENCES
    657897 logo

    canSAR657897

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 513.24
    AlogP 2.18
    HBond donors 3
    HBond acceptors 11
    Atoms 68
    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 canSAR657897.