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canSAR1407153
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NAMES
    SMILES
    C[C@H]1COCCN1c1nc(N2CCCCC2CO)nc2nc(-c3ccc(N)nc3)ccc12
    InChI
    InChI=1S/C23H29N7O2/c1-15-14-32-11-10-29(15)22-18-6-7-19(16-5-8-20(24)25-12-16)26-21(18)27-23(28-22)30-9-3-2-4-17(30)13-31/h5-8,12,15,17,31H,2-4,9-11,13-14H2,1H3,(H2,24,25)/t15-,17?/m0/s1
    MOLECULAR FORMULA
    C23H29N7O2
    CROSS REFERENCES
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    canSAR1407153

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 435.24
    AlogP 2.25
    HBond donors 3
    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 canSAR1407153.