canSAR824074
FEATURES
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NAMES
    SMILES
    CC[C@]1(O)C[C@H]2CN(CCc3c([nH]c4ccc(C(=O)OC)cc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)CC=CN6CC[C@]43[C@@H]65)C2)C1
    InChI
    InChI=1S/C48H60N4O11/c1-9-44(57)23-28-24-47(42(55)61-7,37-30(14-18-51(25-28)26-44)31-20-29(38(54)60-6)12-13-34(31)49-37)33-21-32-35(22-36(33)59-5)50(4)40-46(32)16-19-52-17-11-15-45(10-2,39(46)52)41(63-27(3)53)48(40,58)43(56)62-8/h11-13,17,20-22,28,39-41,49,57-58H,9-10,14-16,18-19,23-26H2,1-8H3/t28-,39+,40-,41-,44+,45-,46-,47+,48+/m1/s1
    MOLECULAR FORMULA
    C48H60N4O11
    CROSS REFERENCES
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    canSAR824074
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight868.43
    AlogP4.13
    HBond donors3
    HBond acceptors15
    Atoms123
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824074.