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canSAR2015617
FEATURES
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NAMES
    SMILES
    CC(C)(O)[C@H](F)CNC(=O)c1cnc(-n2ncc3cc(C#N)cnc32)cc1NC1CN(c2ncc(F)cn2)C1
    InChI
    InChI=1S/C25H24F2N10O2/c1-25(2,39)20(27)11-31-23(38)18-10-29-21(37-22-15(7-34-37)3-14(5-28)6-30-22)4-19(18)35-17-12-36(13-17)24-32-8-16(26)9-33-24/h3-4,6-10,17,20,39H,11-13H2,1-2H3,(H,29,35)(H,31,38)/t20-/m1/s1
    MOLECULAR FORMULA
    C25H24F2N10O2
    CROSS REFERENCES
    2015617 logo

    canSAR2015617

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 534.21
    AlogP 1.76
    HBond donors 3
    HBond acceptors 12
    Atoms 63
    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 canSAR2015617.