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canSAR828714
FEATURES
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NAMES
    SMILES
    CC(C)C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)N)CCCCNC(=O)C[C@@H](C(N)=O)NC(=O)[C@H](CCCN=C(N)N)NC1=O
    InChI
    InChI=1S/C34H55N11O7/c1-19(2)16-25-32(51)42-23(13-9-15-40-34(37)38)30(49)43-24(28(36)47)18-27(46)39-14-8-7-12-22(31(50)45-25)41-33(52)26(44-29(48)20(3)35)17-21-10-5-4-6-11-21/h4-6,10-11,19-20,22-26H,7-9,12-18,35H2,1-3H3,(H2,36,47)(H,39,46)(H,41,52)(H,42,51)(H,43,49)(H,44,48)(H,45,50)(H4,37,38,40)/t20-,22-,23-,24-,25-,26-/m0/s1
    MOLECULAR FORMULA
    C34H55N11O7
    CROSS REFERENCES
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    canSAR828714

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 729.43
    AlogP -2.72
    HBond donors 14
    HBond acceptors 18
    Atoms 107
    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 canSAR828714.