canSAR210018
FEATURES
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NAMES
    SMILES
    C[C@H](NC(=O)[C@@H](O)[C@H](N)CSCC1CCCCC1)c1cccc2ccccc12
    InChI
    InChI=1S/C23H32N2O2S/c1-16(19-13-7-11-18-10-5-6-12-20(18)19)25-23(27)22(26)21(24)15-28-14-17-8-3-2-4-9-17/h5-7,10-13,16-17,21-22,26H,2-4,8-9,14-15,24H2,1H3,(H,25,27)/t16-,21+,22-/m0/s1
    MOLECULAR FORMULA
    C23H32N2O2S
    CROSS REFERENCES
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    canSAR210018
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight400.22
    AlogP4.02
    HBond donors4
    HBond acceptors4
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR210018.