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canSAR1434948
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NAMES
    SMILES
    O=C(CCC1N=C2c3ccccc3N=C(SCc3cccc(F)c3)N2C1=O)NCc1cccs1
    InChI
    InChI=1S/C25H21FN4O2S2/c26-17-6-3-5-16(13-17)15-34-25-29-20-9-2-1-8-19(20)23-28-21(24(32)30(23)25)10-11-22(31)27-14-18-7-4-12-33-18/h1-9,12-13,21H,10-11,14-15H2,(H,27,31)
    MOLECULAR FORMULA
    C25H21FN4O2S2
    CROSS REFERENCES
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    canSAR1434948

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 492.11
    AlogP 4.88
    HBond donors 1
    HBond acceptors 6
    Atoms 55
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1434948.