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canSAR345598
FEATURES
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NAMES
    SMILES
    CC(C)C[C@H](CC(=O)NO)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)NCCCN1CCOCC1
    InChI
    InChI=1S/C28H40N4O5/c1-20(2)16-24(19-26(33)31-36)27(34)30-25(18-21-8-9-22-6-3-4-7-23(22)17-21)28(35)29-10-5-11-32-12-14-37-15-13-32/h3-4,6-9,17,20,24-25,36H,5,10-16,18-19H2,1-2H3,(H,29,35)(H,30,34)(H,31,33)/t24-,25-/m1/s1
    MOLECULAR FORMULA
    C28H40N4O5
    CROSS REFERENCES
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    canSAR345598

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 512.30
    AlogP 2.26
    HBond donors 4
    HBond acceptors 9
    Atoms 77
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR345598.