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canSAR1403755
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NAMES
    SMILES
    CCN=C(S)N(CCc1cccc(C)c1)Cc1cc2cc(OC)c(OC)cc2nc1O
    InChI
    InChI=1S/C24H29N3O3S/c1-5-25-24(31)27(10-9-17-8-6-7-16(2)11-17)15-19-12-18-13-21(29-3)22(30-4)14-20(18)26-23(19)28/h6-8,11-14H,5,9-10,15H2,1-4H3,(H,25,31)(H,26,28)
    MOLECULAR FORMULA
    C24H29N3O3S
    CROSS REFERENCES
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    canSAR1403755

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.19
    AlogP 4.62
    HBond donors 1
    HBond acceptors 6
    Atoms 60
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1403755.