canSAR2096954
FEATURES
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NAMES
    SMILES
    N[C@H](COc1nc(-c2ccncc2)nc2sc3c(c12)CCCC3)C1CCCCC1
    InChI
    InChI=1S/C23H28N4OS/c24-18(15-6-2-1-3-7-15)14-28-22-20-17-8-4-5-9-19(17)29-23(20)27-21(26-22)16-10-12-25-13-11-16/h10-13,15,18H,1-9,14,24H2/t18-/m1/s1
    MOLECULAR FORMULA
    C23H28N4OS
    CROSS REFERENCES
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    canSAR2096954
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight408.20
    AlogP4.92
    HBond donors2
    HBond acceptors5
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2096954.