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canSAR832240
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NAMES
    SMILES
    O=C1O[C@]2(CC[C@H](CNc3ccc(-c4ccccc4F)nn3)CC2)CN1c1cccnn1
    InChI
    InChI=1S/C23H23FN6O2/c24-18-5-2-1-4-17(18)19-7-8-20(28-27-19)25-14-16-9-11-23(12-10-16)15-30(22(31)32-23)21-6-3-13-26-29-21/h1-8,13,16H,9-12,14-15H2,(H,25,28)/t16-,23-
    MOLECULAR FORMULA
    C23H23FN6O2
    CROSS REFERENCES
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    canSAR832240

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 434.19
    AlogP 4.07
    HBond donors 1
    HBond acceptors 8
    Atoms 55
    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 canSAR832240.