650345 logo
canSAR650345
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCCOC(=O)N1CCN(C(=O)[C@H](CCC(=O)O)NC(=O)c2cc(CCCNCC(C)C)cc(-c3ccccc3)n2)CC1
    InChI
    InChI=1S/C34H49N5O6/c1-4-5-9-21-45-34(44)39-19-17-38(18-20-39)33(43)28(14-15-31(40)41)37-32(42)30-23-26(11-10-16-35-24-25(2)3)22-29(36-30)27-12-7-6-8-13-27/h6-8,12-13,22-23,25,28,35H,4-5,9-11,14-21,24H2,1-3H3,(H,37,42)(H,40,41)/t28-/m0/s1
    MOLECULAR FORMULA
    C34H49N5O6
    CROSS REFERENCES
    650345 logo

    canSAR650345

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 623.37
    AlogP 4.36
    HBond donors 3
    HBond acceptors 11
    Atoms 94
    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 canSAR650345.