canSAR586553
FEATURES
Loading...
NAMES
    SMILES
    CC1(C)N=C(N)N=C(N)N1c1cccc(NC(=O)Nc2cccc(N3C(N)=NC(N)=NC3(C)C)c2)c1.Cl.Cl
    InChI
    InChI=1S/C23H30N12O.2ClH/c1-22(2)32-17(24)30-19(26)34(22)15-9-5-7-13(11-15)28-21(36)29-14-8-6-10-16(12-14)35-20(27)31-18(25)33-23(35,3)4;;/h5-12H,1-4H3,(H2,28,29,36)(H4,24,26,30,32)(H4,25,27,31,33);2*1H
    MOLECULAR FORMULA
    C23H32Cl2N12O
    CROSS REFERENCES
    Loading...
    canSAR586553
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight562.22
    AlogP2.55
    HBond donors10
    HBond acceptors13
    Atoms70
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR586553.