canSAR2099057
FEATURES
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NAMES
    SMILES
    CC[C@@H](C)[C@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)C(NC(=O)CCCCCCCCCCCNC(=N)N)CNC(=O)[C@@H](CS)NC(=O)[C@@H](CC(N)=O)NC1=O
    InChI
    InChI=1S/C41H75N11O8S/c1-7-26(6)34-40(60)50-29(21-32(42)53)37(57)51-31(23-61)35(55)46-22-30(47-33(54)17-15-13-11-9-8-10-12-14-16-18-45-41(43)44)39(59)49-27(19-24(2)3)36(56)48-28(20-25(4)5)38(58)52-34/h24-31,34,61H,7-23H2,1-6H3,(H2,42,53)(H,46,55)(H,47,54)(H,48,56)(H,49,59)(H,50,60)(H,51,57)(H,52,58)(H4,43,44,45)/t26-,27-,28+,29-,30?,31-,34-/m1/s1
    MOLECULAR FORMULA
    C41H75N11O8S
    CROSS REFERENCES
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    canSAR2099057
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight881.55
    AlogP0.35
    HBond donors13
    HBond acceptors19
    Atoms136
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2099057.