canSAR1746804
FEATURES
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NAMES
    SMILES
    CC1(C)O[C@@H]2[C@H](O)CN(Cc3ccc(OCCCOc4ccc(CN5C[C@@H](O)[C@H]6OC(C)(C)O[C@@H]6[C@H](O)C5)cc4)cc3)C[C@@H](O)[C@H]2O1.Cl.Cl
    InChI
    InChI=1S/C35H50N2O10.2ClH/c1-34(2)44-30-26(38)18-36(19-27(39)31(30)45-34)16-22-6-10-24(11-7-22)42-14-5-15-43-25-12-8-23(9-13-25)17-37-20-28(40)32-33(29(41)21-37)47-35(3,4)46-32;;/h6-13,26-33,38-41H,5,14-21H2,1-4H3;2*1H/t26-,27-,28-,29-,30-,31-,32-,33-;;/m1../s1
    MOLECULAR FORMULA
    C35H52Cl2N2O10
    CROSS REFERENCES
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    canSAR1746804
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight730.30
    AlogP2.49
    HBond donors4
    HBond acceptors12
    Atoms101
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746804.