1142406 logo
canSAR1142406
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc2[nH]cc(C3=CCN(CCCCN4C(=O)CC(c5c[nH]c6ccccc56)C4=O)CC3)c2c1
    InChI
    InChI=1S/C30H32N4O3/c1-37-21-8-9-28-23(16-21)25(18-31-28)20-10-14-33(15-11-20)12-4-5-13-34-29(35)17-24(30(34)36)26-19-32-27-7-3-2-6-22(26)27/h2-3,6-10,16,18-19,24,31-32H,4-5,11-15,17H2,1H3
    MOLECULAR FORMULA
    C30H32N4O3
    CROSS REFERENCES
    1142406 logo

    canSAR1142406

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.25
    AlogP 5.07
    HBond donors 2
    HBond acceptors 7
    Atoms 69
    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 canSAR1142406.