canSAR734833
FEATURES
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NAMES
    SMILES
    CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC1CC2CCC1C2)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(N)=O
    InChI
    InChI=1S/C38H67N11O9S/c1-19(2)14-28(31(39)52)48-37(58)30(18-50)49-33(54)21(4)44-35(56)27(11-13-59-6)46-32(53)20(3)43-34(55)26(8-7-12-42-38(40)41)47-36(57)29(45-22(5)51)17-25-16-23-9-10-24(25)15-23/h19-21,23-30,50H,7-18H2,1-6H3,(H2,39,52)(H,43,55)(H,44,56)(H,45,51)(H,46,53)(H,47,57)(H,48,58)(H,49,54)(H4,40,41,42)/t20-,21-,23?,24?,25?,26-,27-,28-,29-,30-/m0/s1
    MOLECULAR FORMULA
    C38H67N11O9S
    CROSS REFERENCES
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    canSAR734833
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight853.48
    AlogP-2.40
    HBond donors14
    HBond acceptors20
    Atoms126
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR734833.