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canSAR743055
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NAMES
    SMILES
    Cc1csc(-c2ccc(CNc3nc(N[C@H]4CC[C@H](N)CC4)nc4c3ncn4C(C)C)s2)n1
    InChI
    InChI=1S/C23H30N8S2/c1-13(2)31-12-26-19-20(25-10-17-8-9-18(33-17)22-27-14(3)11-32-22)29-23(30-21(19)31)28-16-6-4-15(24)5-7-16/h8-9,11-13,15-16H,4-7,10,24H2,1-3H3,(H2,25,28,29,30)/t15-,16-
    MOLECULAR FORMULA
    C23H30N8S2
    CROSS REFERENCES
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    canSAR743055

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.20
    AlogP 5.19
    HBond donors 4
    HBond acceptors 8
    Atoms 63
    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 canSAR743055.