391334 logo
canSAR391334
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(CO)NC(CCS)C(=O)N[C@H](Cc1ccccc1)C(=O)O
    InChI
    InChI=1S/C15H20N2O5S/c18-9-13(19)16-11(6-7-23)14(20)17-12(15(21)22)8-10-4-2-1-3-5-10/h1-5,11-12,18,23H,6-9H2,(H,16,19)(H,17,20)(H,21,22)/t11?,12-/m1/s1
    MOLECULAR FORMULA
    C15H20N2O5S
    CROSS REFERENCES
    391334 logo

    canSAR391334

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.11
    AlogP -0.40
    HBond donors 4
    HBond acceptors 7
    Atoms 43
    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 canSAR391334.