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canSAR1131995
FEATURES
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NAMES
    SMILES
    Cc1noc(CC[C@H]2CC[C@H](c3ccc(N4CCOc5ncnc(N)c5C4=O)cc3)CC2)n1
    InChI
    InChI=1S/C24H28N6O3/c1-15-28-20(33-29-15)11-4-16-2-5-17(6-3-16)18-7-9-19(10-8-18)30-12-13-32-23-21(24(30)31)22(25)26-14-27-23/h7-10,14,16-17H,2-6,11-13H2,1H3,(H2,25,26,27)/t16-,17-
    MOLECULAR FORMULA
    C24H28N6O3
    CROSS REFERENCES
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    canSAR1131995

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 448.22
    AlogP 3.70
    HBond donors 2
    HBond acceptors 9
    Atoms 61
    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 canSAR1131995.