660055 logo
canSAR660055
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCC(CCCC)c1cc[n+](CCCCCCCCCCCC[n+]2ccc(C(CCCC)CCCC)cc2)cc1
    InChI
    InChI=1S/C40H70N2/c1-5-9-23-37(24-10-6-2)39-27-33-41(34-28-39)31-21-19-17-15-13-14-16-18-20-22-32-42-35-29-40(30-36-42)38(25-11-7-3)26-12-8-4/h27-30,33-38H,5-26,31-32H2,1-4H3/q+2
    MOLECULAR FORMULA
    C40H70N2+2
    CROSS REFERENCES
    660055 logo

    canSAR660055

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 578.55
    AlogP 11.79
    HBond donors 0
    HBond acceptors 2
    Atoms 112
    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 canSAR660055.