canSAR2080232
FEATURES
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NAMES
    SMILES
    Cl.Cl.Cn1c(N2CCN[C@@H](c3ccc(N4CCC(O)C4)cc3)C2)nc(-c2ccncc2F)cc1=O
    InChI
    InChI=1S/C24H27FN6O2.2ClH/c1-29-23(33)12-21(19-6-8-26-13-20(19)25)28-24(29)31-11-9-27-22(15-31)16-2-4-17(5-3-16)30-10-7-18(32)14-30;;/h2-6,8,12-13,18,22,27,32H,7,9-11,14-15H2,1H3;2*1H/t18?,22-;;/m1../s1
    MOLECULAR FORMULA
    C24H29Cl2FN6O2
    CROSS REFERENCES
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    canSAR2080232
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight522.17
    AlogP2.55
    HBond donors2
    HBond acceptors8
    Atoms64
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2080232.