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canSAR1404221
FEATURES
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NAMES
    SMILES
    C[C@@H]1CN(C(=O)c2ccccc2-n2nccn2)[C@H](Cc2cc(-c3ncccn3)ccc2F)CO1
    InChI
    InChI=1S/C25H23FN6O2/c1-17-15-31(25(33)21-5-2-3-6-23(21)32-29-11-12-30-32)20(16-34-17)14-19-13-18(7-8-22(19)26)24-27-9-4-10-28-24/h2-13,17,20H,14-16H2,1H3/t17-,20-/m1/s1
    MOLECULAR FORMULA
    C25H23FN6O2
    CROSS REFERENCES
    1404221 logo

    canSAR1404221

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 458.19
    AlogP 3.34
    HBond donors 0
    HBond acceptors 8
    Atoms 57
    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 canSAR1404221.