1835879 logo
canSAR1835879
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cccc(C(=O)Nc2n[nH]c3c2CN(C(=O)N2CCN(CC4CCOCC4)C[C@@H]2C)C3(C)C)c1
    InChI
    InChI=1S/C27H38N6O3/c1-18-6-5-7-21(14-18)25(34)28-24-22-17-33(27(3,4)23(22)29-30-24)26(35)32-11-10-31(15-19(32)2)16-20-8-12-36-13-9-20/h5-7,14,19-20H,8-13,15-17H2,1-4H3,(H2,28,29,30,34)/t19-/m0/s1
    MOLECULAR FORMULA
    C27H38N6O3
    CROSS REFERENCES
    1835879 logo

    canSAR1835879

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 494.30
    AlogP 3.57
    HBond donors 2
    HBond acceptors 9
    Atoms 74
    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 canSAR1835879.