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canSAR1718894
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NAMES
    SMILES
    CC1=N[C@H](CC(C)C)C(=O)N(Cc2ccncc2)c2cc(C(=O)OC(C)(C)C)ccc21
    InChI
    InChI=1S/C25H31N3O3/c1-16(2)13-21-23(29)28(15-18-9-11-26-12-10-18)22-14-19(24(30)31-25(4,5)6)7-8-20(22)17(3)27-21/h7-12,14,16,21H,13,15H2,1-6H3/t21-/m1/s1
    MOLECULAR FORMULA
    C25H31N3O3
    CROSS REFERENCES
    1718894 logo

    canSAR1718894

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.24
    AlogP 4.81
    HBond donors 0
    HBond acceptors 6
    Atoms 62
    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 canSAR1718894.