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canSAR1832741
FEATURES
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NAMES
    SMILES
    O=C(c1ccc(Oc2ncccc2[C@H]2CCC[C@H](O)C2)cc1)c1nc2ccccc2[nH]1
    InChI
    InChI=1S/C25H23N3O3/c29-18-6-3-5-17(15-18)20-7-4-14-26-25(20)31-19-12-10-16(11-13-19)23(30)24-27-21-8-1-2-9-22(21)28-24/h1-2,4,7-14,17-18,29H,3,5-6,15H2,(H,27,28)/t17-,18-/m0/s1
    MOLECULAR FORMULA
    C25H23N3O3
    CROSS REFERENCES
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    canSAR1832741

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.17
    AlogP 5.00
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    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 canSAR1832741.