465878 logo
canSAR465878
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COCc1c(CNc2ccc(OC)c(OC)c2)cnc2nc(N)nc(N)c12
    InChI
    InChI=1S/C18H22N6O3/c1-25-9-12-10(8-22-17-15(12)16(19)23-18(20)24-17)7-21-11-4-5-13(26-2)14(6-11)27-3/h4-6,8,21H,7,9H2,1-3H3,(H4,19,20,22,23,24)
    MOLECULAR FORMULA
    C18H22N6O3
    CROSS REFERENCES
    465878 logo

    canSAR465878

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.18
    AlogP 1.96
    HBond donors 5
    HBond acceptors 9
    Atoms 49
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR465878.