canSAR739214
FEATURES
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NAMES
    SMILES
    CCCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC(=O)NCCCC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CCCNC(=N)N)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)C2(Cc3ccccc3C2)NC1=O
    InChI
    InChI=1S/C58H73N13O9/c1-3-4-19-44(65-34(2)72)51(75)69-48-30-49(73)62-25-12-11-21-43(50(59)74)66-54(78)47(29-40-33-64-42-20-10-9-18-41(40)42)68-52(76)45(22-13-26-63-57(60)61)67-53(77)46(28-35-23-24-36-14-5-6-15-37(36)27-35)70-56(80)58(71-55(48)79)31-38-16-7-8-17-39(38)32-58/h5-10,14-18,20,23-24,27,33,43-48,64H,3-4,11-13,19,21-22,25-26,28-32H2,1-2H3,(H2,59,74)(H,62,73)(H,65,72)(H,66,78)(H,67,77)(H,68,76)(H,69,75)(H,70,80)(H,71,79)(H4,60,61,63)/t43-,44+,45+,46-,47-,48+/m0/s1
    MOLECULAR FORMULA
    C58H73N13O9
    CROSS REFERENCES
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    canSAR739214
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1095.57
    AlogP1.32
    HBond donors15
    HBond acceptors22
    Atoms153
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739214.