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canSAR1155551
FEATURES
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NAMES
    SMILES
    CC(C)OP(=O)(OC(C)C)C(NC(=S)N[C@H](C)c1ccccc1)c1ccccc1
    InChI
    InChI=1S/C22H31N2O3PS/c1-16(2)26-28(25,27-17(3)4)21(20-14-10-7-11-15-20)24-22(29)23-18(5)19-12-8-6-9-13-19/h6-18,21H,1-5H3,(H2,23,24,29)/t18-,21?/m1/s1
    MOLECULAR FORMULA
    C22H31N2O3PS
    CROSS REFERENCES
    1155551 logo

    canSAR1155551

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 434.18
    AlogP 5.95
    HBond donors 2
    HBond acceptors 5
    Atoms 60
    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 canSAR1155551.