canSAR1651471
FEATURES
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NAMES
    SMILES
    COCCN=C1OC(=O)N2C(=O)C3=C4[C@@H](C[C@H]5C(=O)N(c6ccccc6)C(=O)[C@H]5[C@H]4[C@@]12Cc1ccccc1)[C@H]1C(=O)N(c2ccccc2)C(=O)[C@H]1[C@H]3C
    InChI
    InChI=1S/C41H36N4O8/c1-22-28-30-26(31-29(22)35(47)44(36(31)48)25-16-10-5-11-17-25)20-27-32(37(49)43(34(27)46)24-14-8-4-9-15-24)33(30)41(21-23-12-6-3-7-13-23)39(42-18-19-52-2)53-40(51)45(41)38(28)50/h3-17,22,26-27,29,31-33H,18-21H2,1-2H3/t22-,26+,27+,29-,31+,32+,33-,41-/m0/s1
    MOLECULAR FORMULA
    C41H36N4O8
    CROSS REFERENCES
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    canSAR1651471
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight712.25
    AlogP4.20
    HBond donors0
    HBond acceptors12
    Atoms89
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1651471.