canSAR1087287
FEATURES
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NAMES
    SMILES
    CCc1cccc(C[C@@H]2NC(=O)[C@@H](N)CCCCCCCCNC(=O)[C@@H]3CCCN3C(=O)[C@H](CCCNC(=N)N)NC(=O)C3(CCC3)NC(=O)[C@@H]3CCCN3C2=O)c1
    InChI
    InChI=1S/C42H66N10O6/c1-2-28-14-9-15-29(26-28)27-32-39(57)52-25-12-19-34(52)37(55)50-42(20-13-21-42)40(58)49-31(17-10-23-47-41(44)45)38(56)51-24-11-18-33(51)36(54)46-22-8-6-4-3-5-7-16-30(43)35(53)48-32/h9,14-15,26,30-34H,2-8,10-13,16-25,27,43H2,1H3,(H,46,54)(H,48,53)(H,49,58)(H,50,55)(H4,44,45,47)/t30-,31-,32-,33-,34-/m0/s1
    MOLECULAR FORMULA
    C42H66N10O6
    CROSS REFERENCES
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    canSAR1087287
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight806.52
    AlogP1.23
    HBond donors10
    HBond acceptors16
    Atoms124
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087287.