830891 logo
canSAR830891
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    NCCCCC(N)C(=O)N[C@H](CCC(=O)N1c2ccccc2C[C@H]1C(=O)O)C(=O)O
    InChI
    InChI=1S/C20H28N4O6/c21-10-4-3-6-13(22)18(26)23-14(19(27)28)8-9-17(25)24-15-7-2-1-5-12(15)11-16(24)20(29)30/h1-2,5,7,13-14,16H,3-4,6,8-11,21-22H2,(H,23,26)(H,27,28)(H,29,30)/t13?,14-,16+/m1/s1
    MOLECULAR FORMULA
    C20H28N4O6
    CROSS REFERENCES
    830891 logo

    canSAR830891

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.20
    AlogP -0.17
    HBond donors 7
    HBond acceptors 10
    Atoms 58
    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 canSAR830891.