1155614 logo
canSAR1155614
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cn([C@H]2C[C@H](n3cc(-c4ccnc5ccccc45)nn3)[C@@H](CO)O2)c(=O)[nH]c1=O
    InChI
    InChI=1S/C21H20N6O4/c1-12-9-26(21(30)23-20(12)29)19-8-17(18(11-28)31-19)27-10-16(24-25-27)14-6-7-22-15-5-3-2-4-13(14)15/h2-7,9-10,17-19,28H,8,11H2,1H3,(H,23,29,30)/t17-,18+,19+/m0/s1
    MOLECULAR FORMULA
    C21H20N6O4
    CROSS REFERENCES
    1155614 logo

    canSAR1155614

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 420.15
    AlogP 1.17
    HBond donors 2
    HBond acceptors 10
    Atoms 51
    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 canSAR1155614.