1524257 logo
canSAR1524257
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccccc1C1c2[nH]c3ccccc3c2C[C@H]2C(=O)N(c3ccccc3C(=O)NCCCN3CCOCC3)C(=O)N12
    InChI
    InChI=1S/C34H35N5O4/c1-22-9-2-3-10-23(22)31-30-26(24-11-4-6-13-27(24)36-30)21-29-33(41)39(34(42)38(29)31)28-14-7-5-12-25(28)32(40)35-15-8-16-37-17-19-43-20-18-37/h2-7,9-14,29,31,36H,8,15-21H2,1H3,(H,35,40)/t29-,31?/m0/s1
    MOLECULAR FORMULA
    C34H35N5O4
    CROSS REFERENCES
    1524257 logo

    canSAR1524257

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 577.27
    AlogP 4.41
    HBond donors 2
    HBond acceptors 9
    Atoms 78
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1524257.