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canSAR741580
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NAMES
    SMILES
    CCCCCCCCN=c1ccn(CCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1.Cl.Cl
    InChI
    InChI=1S/C35H60N4.2ClH/c1-3-5-7-9-14-18-26-36-34-22-30-38(31-23-34)28-20-16-12-11-13-17-21-29-39-32-24-35(25-33-39)37-27-19-15-10-8-6-4-2;;/h22-25,30-33H,3-21,26-29H2,1-2H3;2*1H
    MOLECULAR FORMULA
    C35H62Cl2N4
    CROSS REFERENCES
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    canSAR741580

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 608.44
    AlogP 10.09
    HBond donors 0
    HBond acceptors 4
    Atoms 103
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR741580.