canSAR2063957
FEATURES
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NAMES
    SMILES
    C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](Oc3ccc(CN4CCN(c5ccccc5)CC4)cc3)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4
    InChI
    InChI=1S/C32H42N2O5/c1-22-9-14-28-23(2)29(36-30-32(28)27(22)15-16-31(3,37-30)38-39-32)35-26-12-10-24(11-13-26)21-33-17-19-34(20-18-33)25-7-5-4-6-8-25/h4-8,10-13,22-23,27-30H,9,14-21H2,1-3H3/t22-,23-,27+,28+,29+,30-,31-,32-/m1/s1
    MOLECULAR FORMULA
    C32H42N2O5
    CROSS REFERENCES
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    canSAR2063957
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight534.31
    AlogP5.60
    HBond donors0
    HBond acceptors7
    Atoms81
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2063957.