canSAR823809
FEATURES
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NAMES
    SMILES
    COc1cc2c(cc1OC/C=C/COCCC#Cc1ccccc1C#Cc1ccccc1)N=C[C@@H]1CCCN1C2=O
    InChI
    InChI=1S/C35H32N2O4/c1-39-33-24-31-32(36-26-30-17-11-20-37(30)35(31)38)25-34(33)41-23-10-9-22-40-21-8-7-16-28-14-5-6-15-29(28)19-18-27-12-3-2-4-13-27/h2-6,9-10,12-15,24-26,30H,8,11,17,20-23H2,1H3/b10-9+/t30-/m0/s1
    MOLECULAR FORMULA
    C35H32N2O4
    CROSS REFERENCES
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    canSAR823809
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight544.24
    AlogP5.81
    HBond donors0
    HBond acceptors6
    Atoms73
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823809.