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canSAR745521
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NAMES
    SMILES
    Cc1cccc(-c2ccc(CNc3nc(N[C@H]4CC[C@H](N)CC4)nc4c3ncn4C(C)C)s2)c1
    InChI
    InChI=1S/C26H33N7S/c1-16(2)33-15-29-23-24(31-26(32-25(23)33)30-20-9-7-19(27)8-10-20)28-14-21-11-12-22(34-21)18-6-4-5-17(3)13-18/h4-6,11-13,15-16,19-20H,7-10,14,27H2,1-3H3,(H2,28,30,31,32)/t19-,20-
    MOLECULAR FORMULA
    C26H33N7S
    CROSS REFERENCES
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    canSAR745521

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.25
    AlogP 5.74
    HBond donors 4
    HBond acceptors 7
    Atoms 67
    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 canSAR745521.