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canSAR784969
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](CCCN=C(N)N)C(=O)NC1CC[C@H]2CCCC(C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](Cc3ccc(Cl)cc3)C(N)=O)N2C1=O
    InChI
    InChI=1S/C33H50ClN11O7/c1-18(46)41-22(6-3-15-39-32(36)37)28(48)43-24-14-13-21-5-2-8-26(45(21)31(24)51)30(50)42-23(7-4-16-40-33(38)52)29(49)44-25(27(35)47)17-19-9-11-20(34)12-10-19/h9-12,21-26H,2-8,13-17H2,1H3,(H2,35,47)(H,41,46)(H,42,50)(H,43,48)(H,44,49)(H4,36,37,39)(H3,38,40,52)/t21-,22+,23-,24?,25-,26?/m1/s1
    MOLECULAR FORMULA
    C33H50ClN11O7
    CROSS REFERENCES
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    canSAR784969

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 747.36
    AlogP -1.63
    HBond donors 13
    HBond acceptors 18
    Atoms 102
    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 canSAR784969.