1128831 logo
canSAR1128831
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCc1sc(-c2cccc(F)c2)nc1CSc1nc(N)cc(N)n1
    InChI
    InChI=1S/C17H18FN5S2/c1-2-4-13-12(9-24-17-22-14(19)8-15(20)23-17)21-16(25-13)10-5-3-6-11(18)7-10/h3,5-8H,2,4,9H2,1H3,(H4,19,20,22,23)
    MOLECULAR FORMULA
    C17H18FN5S2
    CROSS REFERENCES
    1128831 logo

    canSAR1128831

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 375.10
    AlogP 4.15
    HBond donors 4
    HBond acceptors 5
    Atoms 43
    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 canSAR1128831.