785167 logo
canSAR785167
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(/C=C\C(=O)N1CCCN(C(c2ccccc2)c2ccc(Cl)cc2)CC1)NC1CCCCC1
    InChI
    InChI=1S/C28H34ClN3O2/c29-24-14-12-23(13-15-24)28(22-8-3-1-4-9-22)32-19-7-18-31(20-21-32)27(34)17-16-26(33)30-25-10-5-2-6-11-25/h1,3-4,8-9,12-17,25,28H,2,5-7,10-11,18-21H2,(H,30,33)/b17-16-
    MOLECULAR FORMULA
    C28H34ClN3O2
    CROSS REFERENCES
    785167 logo

    canSAR785167

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 479.23
    AlogP 4.97
    HBond donors 1
    HBond acceptors 5
    Atoms 68
    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 canSAR785167.