66164 logo
canSAR66164
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C1CC2(CCCCC2)CC(O)=C1C1C2=C(CC3(CCCCC3)CC2=O)Oc2ccccc21
    InChI
    InChI=1S/C29H34O4/c30-20-15-28(11-5-1-6-12-28)16-21(31)26(20)25-19-9-3-4-10-23(19)33-24-18-29(13-7-2-8-14-29)17-22(32)27(24)25/h3-4,9-10,25,30H,1-2,5-8,11-18H2
    MOLECULAR FORMULA
    C29H34O4
    CROSS REFERENCES
    66164 logo

    canSAR66164

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 446.25
    AlogP 6.86
    HBond donors 1
    HBond acceptors 4
    Atoms 67
    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 canSAR66164.