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canSAR164765
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)C(C)C)C(C)C
    InChI
    InChI=1S/C51H74N10O14/c1-27(2)22-34(55-43(66)32(52)23-30-14-9-7-10-15-30)45(68)56-36(25-40(64)65)47(70)54-33(19-20-39(53)63)44(67)59-41(28(3)4)50(73)61-21-13-18-38(61)49(72)57-35(24-31-16-11-8-12-17-31)46(69)58-37(26-62)48(71)60-42(29(5)6)51(74)75/h7-12,14-17,27-29,32-38,41-42,62H,13,18-26,52H2,1-6H3,(H2,53,63)(H,54,70)(H,55,66)(H,56,68)(H,57,72)(H,58,69)(H,59,67)(H,60,71)(H,64,65)(H,74,75)/t32-,33-,34-,35-,36-,37-,38-,41-,42-/m0/s1
    MOLECULAR FORMULA
    C51H74N10O14
    CROSS REFERENCES
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    canSAR164765

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1050.54
    AlogP -1.64
    HBond donors 14
    HBond acceptors 24
    Atoms 149
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR164765.