1861704 logo
canSAR1861704
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)C1CN(Cc2cccc3ccn(C)c23)CCO1
    InChI
    InChI=1S/C29H36ClN3O4/c1-20(2)16-33(17-21-14-24(30)28-25(15-21)35-11-5-12-37-28)29(34)26-19-32(10-13-36-26)18-23-7-4-6-22-8-9-31(3)27(22)23/h4,6-9,14-15,20,26H,5,10-13,16-19H2,1-3H3
    MOLECULAR FORMULA
    C29H36ClN3O4
    CROSS REFERENCES
    1861704 logo

    canSAR1861704

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 525.24
    AlogP 4.88
    HBond donors 0
    HBond acceptors 7
    Atoms 73
    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 canSAR1861704.