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canSAR227859
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)[C@@H](O)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
    InChI
    InChI=1S/C48H68N10O9/c1-28(2)20-35(41(60)25-42(61)54-37(21-29(3)4)46(65)56-36(43(49)62)22-32-14-9-7-10-15-32)55-44(63)30(5)52-45(64)38(23-33-16-11-8-12-17-33)57-47(66)40-18-13-19-58(40)48(67)39(53-31(6)59)24-34-26-50-27-51-34/h7-12,14-17,26-30,35-41,60H,13,18-25H2,1-6H3,(H2,49,62)(H,50,51)(H,52,64)(H,53,59)(H,54,61)(H,55,63)(H,56,65)(H,57,66)/t30-,35+,36+,37+,38+,39+,40-,41+/m1/s1
    MOLECULAR FORMULA
    C48H68N10O9
    CROSS REFERENCES
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    canSAR227859

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 928.52
    AlogP 0.71
    HBond donors 10
    HBond acceptors 19
    Atoms 135
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR227859.