canSAR1089905
FEATURES
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NAMES
    SMILES
    CC(=O)OC[C@]1(C)[C@@H](OC(C)=O)CC[C@]2(C)[C@H]3[C@@H](O)c4c(cc(-c5cccnc5)oc4=O)O[C@]3(C)[C@@H](OC(=O)c3cccc(Cl)c3)C[C@H]21
    InChI
    InChI=1S/C36H38ClNO10/c1-19(39)44-18-35(4)26-16-28(47-32(42)21-8-6-10-23(37)14-21)36(5)31(34(26,3)12-11-27(35)45-20(2)40)30(41)29-25(48-36)15-24(46-33(29)43)22-9-7-13-38-17-22/h6-10,13-15,17,26-28,30-31,41H,11-12,16,18H2,1-5H3/t26-,27+,28+,30+,31-,34+,35+,36-/m1/s1
    MOLECULAR FORMULA
    C36H38ClNO10
    CROSS REFERENCES
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    canSAR1089905
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight679.22
    AlogP5.70
    HBond donors1
    HBond acceptors11
    Atoms86
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1089905.