canSAR1503132
FEATURES
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NAMES
    SMILES
    CN=C(C(C=N)N=C(O)c1nc(-c2c(F)cccc2F)sc1N)N1CC[C@H](N)CC(F)(F)C1
    InChI
    InChI=1S/C20H23F4N7OS/c1-28-17(31-6-5-10(26)7-20(23,24)9-31)13(8-25)29-18(32)15-16(27)33-19(30-15)14-11(21)3-2-4-12(14)22/h2-4,8,10,13,25H,5-7,9,26-27H2,1H3,(H,29,32)/t10-,13?/m0/s1
    MOLECULAR FORMULA
    C20H23F4N7OS
    CROSS REFERENCES
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    canSAR1503132
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight485.16
    AlogP3.08
    HBond donors6
    HBond acceptors8
    Atoms56
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503132.