643169 logo
canSAR643169
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1c2cc[n+](COC(=O)c3ccccc3)cc2c(C)c2c1[nH]c1ccccc12.[I-]
    InChI
    InChI=1S/C25H20N2O2.HI/c1-16-21-14-27(15-29-25(28)18-8-4-3-5-9-18)13-12-19(21)17(2)24-23(16)20-10-6-7-11-22(20)26-24;/h3-14H,15H2,1-2H3;1H
    MOLECULAR FORMULA
    C25H21IN2O2
    CROSS REFERENCES
    643169 logo

    canSAR643169

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 508.06
    AlogP 2.20
    HBond donors 1
    HBond acceptors 4
    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 canSAR643169.