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canSAR1964683
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NAMES
    SMILES
    C[C@H]1COCCN1c1nc(N2CCOC[C@@H]2C)c2ccc(-c3cccc(N)c3)nc2n1
    InChI
    InChI=1S/C23H28N6O2/c1-15-13-30-10-8-28(15)22-19-6-7-20(17-4-3-5-18(24)12-17)25-21(19)26-23(27-22)29-9-11-31-14-16(29)2/h3-7,12,15-16H,8-11,13-14,24H2,1-2H3/t15-,16-/m0/s1
    MOLECULAR FORMULA
    C23H28N6O2
    CROSS REFERENCES
    1964683 logo

    canSAR1964683

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.23
    AlogP 2.72
    HBond donors 2
    HBond acceptors 8
    Atoms 59
    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 canSAR1964683.