canSAR1746394
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H]1CCCNC(=O)CC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccccc2F)NC(=O)[C@H](CC(N)=O)NC1=O
    InChI
    InChI=1S/C48H68FN17O10/c1-25(67)60-32(13-7-19-57-47(52)53)41(71)62-33-14-6-18-56-39(69)17-16-31(40(51)70)61-44(74)36(22-27-24-59-30-12-5-3-10-28(27)30)64-42(72)34(15-8-20-58-48(54)55)63-45(75)35(21-26-9-2-4-11-29(26)49)65-46(76)37(23-38(50)68)66-43(33)73/h2-5,9-12,24,31-37,59H,6-8,13-23H2,1H3,(H2,50,68)(H2,51,70)(H,56,69)(H,60,67)(H,61,74)(H,62,71)(H,63,75)(H,64,72)(H,65,76)(H,66,73)(H4,52,53,57)(H4,54,55,58)/t31-,32-,33-,34-,35+,36-,37-/m0/s1
    MOLECULAR FORMULA
    C48H68FN17O10
    CROSS REFERENCES
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    canSAR1746394
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1061.53
    AlogP-3.92
    HBond donors21
    HBond acceptors27
    Atoms144
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746394.