1689783 logo
canSAR1689783
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@H]1CN([C@H](C)CO)C(=O)c2cc(NC(=O)C3CCCCC3)ccc2O[C@H](C)CCCCO[C@@H]1CN(C)S(=O)(=O)c1cccs1
    InChI
    InChI=1S/C33H49N3O7S2/c1-23-20-36(24(2)22-37)33(39)28-19-27(34-32(38)26-12-6-5-7-13-26)15-16-29(28)43-25(3)11-8-9-17-42-30(23)21-35(4)45(40,41)31-14-10-18-44-31/h10,14-16,18-19,23-26,30,37H,5-9,11-13,17,20-22H2,1-4H3,(H,34,38)/t23-,24+,25+,30+/m0/s1
    MOLECULAR FORMULA
    C33H49N3O7S2
    CROSS REFERENCES
    1689783 logo

    canSAR1689783

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 663.30
    AlogP 5.38
    HBond donors 2
    HBond acceptors 10
    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 canSAR1689783.