1986367 logo
canSAR1986367
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cccc(C)c1-c1cc(C)c2nc(Nc3ccc(OCCCN4CCN(C)CC4)cc3)nnc2c1
    InChI
    InChI=1S/C30H36N6O/c1-21-7-5-8-22(2)28(21)24-19-23(3)29-27(20-24)33-34-30(32-29)31-25-9-11-26(12-10-25)37-18-6-13-36-16-14-35(4)15-17-36/h5,7-12,19-20H,6,13-18H2,1-4H3,(H,31,32,34)
    MOLECULAR FORMULA
    C30H36N6O
    CROSS REFERENCES
    1986367 logo

    canSAR1986367

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 496.30
    AlogP 5.38
    HBond donors 1
    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 canSAR1986367.