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canSAR1830172
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NAMES
    SMILES
    COCCNc1ncnc2c1ncn2[C@H]1CN(Cc2ccc(F)cc2)C[C@@H](CO)O1
    InChI
    InChI=1S/C20H25FN6O3/c1-29-7-6-22-19-18-20(24-12-23-19)27(13-25-18)17-10-26(9-16(11-28)30-17)8-14-2-4-15(21)5-3-14/h2-5,12-13,16-17,28H,6-11H2,1H3,(H,22,23,24)/t16-,17+/m0/s1
    MOLECULAR FORMULA
    C20H25FN6O3
    CROSS REFERENCES
    1830172 logo

    canSAR1830172

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.20
    AlogP 1.42
    HBond donors 2
    HBond acceptors 9
    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 canSAR1830172.