canSAR824738
FEATURES
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NAMES
    SMILES
    C[C@@H](c1ccccc1)[C@@H]1NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]([C@@H](O)[C@@H]2CNC(N)N2[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)NC(=O)[C@H]([C@@H](O)[C@@H]2CNC(N)N2)NC(=O)[C@@H](Cc2ccc(O[C@H]3O[C@H](COC(=O)Cc4ccccc4)[C@@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@H](O)[C@@H]3O)cc2)NC1=O
    InChI
    InChI=1S/C62H88N12O26/c1-25(28-10-6-3-7-11-28)39-55(92)68-30(16-27-12-14-29(15-13-27)96-59-51(89)48(86)52(100-60-50(88)47(85)45(83)35(23-77)98-60)36(99-59)24-95-38(79)17-26-8-4-2-5-9-26)54(91)72-40(42(80)31-18-66-61(63)70-31)57(94)73-41(56(93)69-32(21-75)53(90)65-20-37(78)71-39)43(81)33-19-67-62(64)74(33)58-49(87)46(84)44(82)34(22-76)97-58/h2-15,25,30-36,39-52,58-62,66-67,70,75-77,80-89H,16-24,63-64H2,1H3,(H,65,90)(H,68,92)(H,69,93)(H,71,78)(H,72,91)(H,73,94)/t25-,30+,31-,32-,33-,34+,35+,36+,39-,40-,41+,42-,43-,44+,45+,46-,47-,48+,49-,50-,51-,52+,58-,59-,60+,61?,62?/m0/s1
    MOLECULAR FORMULA
    C62H88N12O26
    CROSS REFERENCES
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    canSAR824738
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1416.59
    AlogP-12.78
    HBond donors26
    HBond acceptors38
    Atoms188
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR824738.