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canSAR2203197
FEATURES
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NAMES
    SMILES
    CC1(C)c2cnc(NC3CCOCC3)nc2CN1C(=O)N[C@@H]1CCCN(S(=O)(=O)c2ccccc2F)C1
    InChI
    InChI=1S/C25H33FN6O4S/c1-25(2)19-14-27-23(28-17-9-12-36-13-10-17)30-21(19)16-32(25)24(33)29-18-6-5-11-31(15-18)37(34,35)22-8-4-3-7-20(22)26/h3-4,7-8,14,17-18H,5-6,9-13,15-16H2,1-2H3,(H,29,33)(H,27,28,30)/t18-/m1/s1
    MOLECULAR FORMULA
    C25H33FN6O4S
    CROSS REFERENCES
    2203197 logo

    canSAR2203197

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 532.23
    AlogP 2.82
    HBond donors 2
    HBond acceptors 10
    Atoms 70
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2203197.