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canSAR650595
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NAMES
    SMILES
    O=C(NC1(C(F)(F)F)CCC1)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(Cl)cc2)c1Cn1cncn1
    InChI
    InChI=1S/C24H18Cl3F3N6O/c25-15-4-2-14(3-5-15)21-17(11-35-13-31-12-32-35)20(22(37)33-23(8-1-9-23)24(28,29)30)34-36(21)19-7-6-16(26)10-18(19)27/h2-7,10,12-13H,1,8-9,11H2,(H,33,37)
    MOLECULAR FORMULA
    C24H18Cl3F3N6O
    CROSS REFERENCES
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    canSAR650595

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 568.06
    AlogP 6.35
    HBond donors 1
    HBond acceptors 7
    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 canSAR650595.