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canSAR1128381
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)C[C@H](Cc1ccccc1)C(=O)O)C(C)C
    InChI
    InChI=1S/C31H49N7O8/c1-17(2)13-22(36-27(42)21(32)11-8-12-35-31(33)34)28(43)37-23(16-25(40)41)29(44)38-26(18(3)4)24(39)15-20(30(45)46)14-19-9-6-5-7-10-19/h5-7,9-10,17-18,20-23,26H,8,11-16,32H2,1-4H3,(H,36,42)(H,37,43)(H,38,44)(H,40,41)(H,45,46)(H4,33,34,35)/t20-,21-,22-,23-,26-/m0/s1
    MOLECULAR FORMULA
    C31H49N7O8
    CROSS REFERENCES
    1128381 logo

    canSAR1128381

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 647.36
    AlogP -0.10
    HBond donors 11
    HBond acceptors 15
    Atoms 95
    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 canSAR1128381.