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canSAR833289
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@@H]1NC(=O)[C@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](C)NC(=O)[C@H](CCC(N)=O)NC1=O
    InChI
    InChI=1S/C38H57N9O11/c1-7-20(2)31-36(56)43-24(13-16-28(39)48)34(54)41-21(3)32(52)42-25(14-17-29(40)49)35(55)44-26(15-18-30(50)51)37(57)47(6)27(19-23-11-9-8-10-12-23)38(58)46(5)22(4)33(53)45-31/h8-12,20-22,24-27,31H,7,13-19H2,1-6H3,(H2,39,48)(H2,40,49)(H,41,54)(H,42,52)(H,43,56)(H,44,55)(H,45,53)(H,50,51)/t20-,21+,22-,24-,25-,26-,27-,31-/m0/s1
    MOLECULAR FORMULA
    C38H57N9O11
    CROSS REFERENCES
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    canSAR833289

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 815.42
    AlogP -2.20
    HBond donors 10
    HBond acceptors 20
    Atoms 115
    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 canSAR833289.