1095358 logo
canSAR1095358
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(OC)cc(C(=O)OCCCCNC(=N)NCCS)c1
    InChI
    InChI=1S/C16H25N3O4S/c1-21-13-9-12(10-14(11-13)22-2)15(20)23-7-4-3-5-18-16(17)19-6-8-24/h9-11,24H,3-8H2,1-2H3,(H3,17,18,19)
    MOLECULAR FORMULA
    C16H25N3O4S
    CROSS REFERENCES
    1095358 logo

    canSAR1095358

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 355.16
    AlogP 1.68
    HBond donors 3
    HBond acceptors 7
    Atoms 49
    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 canSAR1095358.