1828074 logo
canSAR1828074
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCc1cn(C[C@H]2CC[C@@H]([C@@H]3CC[C@H](Cn4cc(CCCC)nn4)O3)O2)nn1
    InChI
    InChI=1S/C22H36N6O2/c1-3-5-7-17-13-27(25-23-17)15-19-9-11-21(29-19)22-12-10-20(30-22)16-28-14-18(24-26-28)8-6-4-2/h13-14,19-22H,3-12,15-16H2,1-2H3/t19-,20-,21+,22+/m1/s1
    MOLECULAR FORMULA
    C22H36N6O2
    CROSS REFERENCES
    1828074 logo

    canSAR1828074

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 416.29
    AlogP 3.35
    HBond donors 0
    HBond acceptors 8
    Atoms 66
    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 canSAR1828074.