66886 logo
canSAR66886
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCc1c(OCCCOc2ccc(CCCC(=O)O)cc2)ccc2c(-c3ccccc3)noc12
    InChI
    InChI=1S/C29H31NO5/c1-2-8-24-26(18-17-25-28(30-35-29(24)25)22-10-4-3-5-11-22)34-20-7-19-33-23-15-13-21(14-16-23)9-6-12-27(31)32/h3-5,10-11,13-18H,2,6-9,12,19-20H2,1H3,(H,31,32)
    MOLECULAR FORMULA
    C29H31NO5
    CROSS REFERENCES
    66886 logo

    canSAR66886

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.22
    AlogP 6.70
    HBond donors 1
    HBond acceptors 6
    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 canSAR66886.