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canSAR781890
FEATURES
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NAMES
    SMILES
    CCC(=O)CCCCC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H]([C@@H](C)CC)NC[C@H](Cc2c[nH]c3ccccc23)NC1=O
    InChI
    InChI=1S/C32H47N5O4/c1-4-21(3)29-32(41)37-17-11-16-28(37)31(40)36-27(15-8-6-7-12-24(38)5-2)30(39)35-23(20-34-29)18-22-19-33-26-14-10-9-13-25(22)26/h9-10,13-14,19,21,23,27-29,33-34H,4-8,11-12,15-18,20H2,1-3H3,(H,35,39)(H,36,40)/t21-,23-,27-,28+,29-/m0/s1
    MOLECULAR FORMULA
    C32H47N5O4
    CROSS REFERENCES
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    canSAR781890

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 565.36
    AlogP 3.62
    HBond donors 4
    HBond acceptors 9
    Atoms 88
    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 canSAR781890.