345162 logo
canSAR345162
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)=CCC/C(C)=C/CC/C(C)=C/CC(C(=O)N[C@@H](Cc1ccccc1)C(=O)O)P(=O)(O)O
    InChI
    InChI=1S/C26H38NO6P/c1-19(2)10-8-11-20(3)12-9-13-21(4)16-17-24(34(31,32)33)25(28)27-23(26(29)30)18-22-14-6-5-7-15-22/h5-7,10,12,14-16,23-24H,8-9,11,13,17-18H2,1-4H3,(H,27,28)(H,29,30)(H2,31,32,33)/b20-12+,21-16+/t23-,24?/m0/s1
    MOLECULAR FORMULA
    C26H38NO6P
    CROSS REFERENCES
    345162 logo

    canSAR345162

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.24
    AlogP 5.15
    HBond donors 4
    HBond acceptors 7
    Atoms 72
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR345162.