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canSAR1206238
FEATURES
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NAMES
    SMILES
    CCCCC/C=C/CC(=O)N(C(C)=O)[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H](Cc1ccc(NC(=N)N)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(N)=O
    InChI
    InChI=1S/C42H62FN11O6/c1-5-6-7-8-9-10-13-36(56)54(27(4)55)35(25-29-14-18-30(43)19-15-29)40(60)53-34(24-28-16-20-31(21-17-28)50-42(47)48)39(59)52-33(23-26(2)3)38(58)51-32(37(44)57)12-11-22-49-41(45)46/h9-10,14-21,26,32-35H,5-8,11-13,22-25H2,1-4H3,(H2,44,57)(H,51,58)(H,52,59)(H,53,60)(H4,45,46,49)(H4,47,48,50)/b10-9+/t32-,33-,34-,35-/m0/s1
    MOLECULAR FORMULA
    C42H62FN11O6
    CROSS REFERENCES
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    canSAR1206238

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 835.49
    AlogP 2.23
    HBond donors 13
    HBond acceptors 17
    Atoms 122
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1206238.