canSAR2162701
FEATURES
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NAMES
    SMILES
    COc1cc(OC)cc(N(CC#Cc2cc(OC)ccn2)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1
    InChI
    InChI=1S/C29H26N6O3/c1-34-19-20(17-32-34)29-18-31-27-8-7-22(15-28(27)33-29)35(23-13-25(37-3)16-26(14-23)38-4)11-5-6-21-12-24(36-2)9-10-30-21/h7-10,12-19H,11H2,1-4H3
    MOLECULAR FORMULA
    C29H26N6O3
    CROSS REFERENCES
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    canSAR2162701
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight506.21
    AlogP4.64
    HBond donors0
    HBond acceptors9
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2162701.