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canSAR151994
FEATURES
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NAMES
    SMILES
    CN(Cc1ccccc1)Cc1c(-c2ccc(NC3=NCCN3)cc2)sc2c1c(=O)n(-c1ccccc1)c(=O)n2Cc1c(F)cccc1F
    InChI
    InChI=1S/C37H32F2N6O2S/c1-43(21-24-9-4-2-5-10-24)22-29-32-34(46)45(27-11-6-3-7-12-27)37(47)44(23-28-30(38)13-8-14-31(28)39)35(32)48-33(29)25-15-17-26(18-16-25)42-36-40-19-20-41-36/h2-18H,19-23H2,1H3,(H2,40,41,42)
    MOLECULAR FORMULA
    C37H32F2N6O2S
    CROSS REFERENCES
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    canSAR151994

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 662.23
    AlogP 6.21
    HBond donors 2
    HBond acceptors 8
    Atoms 80
    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 canSAR151994.