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canSAR1969479
FEATURES
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NAMES
    SMILES
    O=C(CNc1ncnc2ccc(C(F)(F)F)cc12)NC1CN([C@H]2CC[C@@H](C3CCCCC3)CC2)C1
    InChI
    InChI=1S/C26H34F3N5O/c27-26(28,29)19-8-11-23-22(12-19)25(32-16-31-23)30-13-24(35)33-20-14-34(15-20)21-9-6-18(7-10-21)17-4-2-1-3-5-17/h8,11-12,16-18,20-21H,1-7,9-10,13-15H2,(H,33,35)(H,30,31,32)/t18-,21+
    MOLECULAR FORMULA
    C26H34F3N5O
    CROSS REFERENCES
    1969479 logo

    canSAR1969479

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 489.27
    AlogP 5.00
    HBond donors 2
    HBond acceptors 6
    Atoms 69
    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 canSAR1969479.