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canSAR839551
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NAMES
    SMILES
    CCN1C(=O)c2c(ncn2Cc2ccc(OC)cc2)N2C1=N[C@@H]1CCC[C@@H]12
    InChI
    InChI=1S/C20H23N5O2/c1-3-24-19(26)17-18(25-16-6-4-5-15(16)22-20(24)25)21-12-23(17)11-13-7-9-14(27-2)10-8-13/h7-10,12,15-16H,3-6,11H2,1-2H3/t15-,16+/m1/s1
    MOLECULAR FORMULA
    C20H23N5O2
    CROSS REFERENCES
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    canSAR839551

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 365.19
    AlogP 2.51
    HBond donors 0
    HBond acceptors 7
    Atoms 50
    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 canSAR839551.