canSAR1746215
FEATURES
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NAMES
    SMILES
    O=C(c1nn([C@H]2CCCN(C3CCCOC3)C2)c2c1CS(=O)(=O)c1c(F)cccc1-2)N1CCOCC1
    InChI
    InChI=1S/C25H31FN4O5S/c26-21-7-1-6-19-23-20(16-36(32,33)24(19)21)22(25(31)28-9-12-34-13-10-28)27-30(23)17-4-2-8-29(14-17)18-5-3-11-35-15-18/h1,6-7,17-18H,2-5,8-16H2/t17-,18?/m0/s1
    MOLECULAR FORMULA
    C25H31FN4O5S
    CROSS REFERENCES
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    canSAR1746215
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight518.20
    AlogP2.26
    HBond donors0
    HBond acceptors9
    Atoms67
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746215.