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canSAR504054
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NAMES
    SMILES
    CC(C)(C)c1cnc(CSc2cnc(NC(=O)[C@H]3CC[C@@H](N)CC3)s2)o1
    InChI
    InChI=1S/C18H26N4O2S2/c1-18(2,3)13-8-20-14(24-13)10-25-15-9-21-17(26-15)22-16(23)11-4-6-12(19)7-5-11/h8-9,11-12H,4-7,10,19H2,1-3H3,(H,21,22,23)/t11-,12+
    MOLECULAR FORMULA
    C18H26N4O2S2
    CROSS REFERENCES
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    canSAR504054

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 394.15
    AlogP 4.18
    HBond donors 3
    HBond acceptors 6
    Atoms 52
    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 canSAR504054.