1720925 logo
canSAR1720925
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCCC(=O)N1C[C@@H](n2cc(COC(=O)c3ccccc3)nn2)[C@H](O)C[C@@H]1c1ccc(C)cc1
    InChI
    InChI=1S/C28H34N4O4/c1-3-4-6-11-27(34)31-18-25(26(33)16-24(31)21-14-12-20(2)13-15-21)32-17-23(29-30-32)19-36-28(35)22-9-7-5-8-10-22/h5,7-10,12-15,17,24-26,33H,3-4,6,11,16,18-19H2,1-2H3/t24-,25-,26-/m1/s1
    MOLECULAR FORMULA
    C28H34N4O4
    CROSS REFERENCES
    1720925 logo

    canSAR1720925

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 490.26
    AlogP 4.40
    HBond donors 1
    HBond acceptors 8
    Atoms 70
    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 canSAR1720925.