canSAR1085065
FEATURES
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NAMES
    SMILES
    COc1cc([C@@H]2c3cc4c(cc3[C@@H](NC(=O)c3cc(-c5ccc(F)cc5)[nH]n3)[C@H]3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC
    InChI
    InChI=1S/C32H28FN3O8/c1-39-25-8-16(9-26(40-2)30(25)41-3)27-18-10-23-24(44-14-43-23)11-19(18)29(20-13-42-32(38)28(20)27)34-31(37)22-12-21(35-36-22)15-4-6-17(33)7-5-15/h4-12,20,27-29H,13-14H2,1-3H3,(H,34,37)(H,35,36)/t20-,27+,28-,29+/m0/s1
    MOLECULAR FORMULA
    C32H28FN3O8
    CROSS REFERENCES
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    canSAR1085065
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight601.19
    AlogP4.38
    HBond donors2
    HBond acceptors11
    Atoms72
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1085065.