canSAR160520
FEATURES
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NAMES
    SMILES
    CCCN1CC[C@]23c4c5ccc(O)c4O[C@H]2c2c(c(-c4ccccc4)cn2Cc2ccccc2)C[C@@]3(O)C1C5
    InChI
    InChI=1S/C34H34N2O3/c1-2-16-35-17-15-33-29-24-13-14-27(37)31(29)39-32(33)30-25(19-34(33,38)28(35)18-24)26(23-11-7-4-8-12-23)21-36(30)20-22-9-5-3-6-10-22/h3-14,21,28,32,37-38H,2,15-20H2,1H3/t28?,32-,33-,34+/m0/s1
    MOLECULAR FORMULA
    C34H34N2O3
    CROSS REFERENCES
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    canSAR160520
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight518.26
    AlogP5.61
    HBond donors2
    HBond acceptors5
    Atoms73
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR160520.