1015377 logo
canSAR1015377
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCCc1ccc(S(=O)(=O)N[C@H]2CC[C@H]3[C@@H]4CCc5cc(O)ccc5[C@H]4CC[C@]23C)cc1
    InChI
    InChI=1S/C29H39NO3S/c1-3-4-5-6-20-7-11-23(12-8-20)34(32,33)30-28-16-15-27-26-13-9-21-19-22(31)10-14-24(21)25(26)17-18-29(27,28)2/h7-8,10-12,14,19,25-28,30-31H,3-6,9,13,15-18H2,1-2H3/t25-,26-,27+,28+,29+/m1/s1
    MOLECULAR FORMULA
    C29H39NO3S
    CROSS REFERENCES
    1015377 logo

    canSAR1015377

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 481.27
    AlogP 6.33
    HBond donors 2
    HBond acceptors 4
    Atoms 73
    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 canSAR1015377.