canSAR734643
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(N)=O
    InChI
    InChI=1S/C50H60N10O10/c1-4-28(2)44(49(69)57-38(21-30-13-6-5-7-14-30)46(66)56-37(45(51)65)24-43(63)64)59-42(62)27-54-48(68)41-19-12-20-60(41)50(70)40(23-32-26-53-36-18-11-9-16-34(32)36)58-47(67)39(55-29(3)61)22-31-25-52-35-17-10-8-15-33(31)35/h5-11,13-18,25-26,28,37-41,44,52-53H,4,12,19-24,27H2,1-3H3,(H2,51,65)(H,54,68)(H,55,61)(H,56,66)(H,57,69)(H,58,67)(H,59,62)(H,63,64)/t28-,37-,38-,39-,40-,41-,44-/m0/s1
    MOLECULAR FORMULA
    C50H60N10O10
    CROSS REFERENCES
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    canSAR734643
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight960.45
    AlogP1.23
    HBond donors11
    HBond acceptors20
    Atoms130
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR734643.