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canSAR649465
FEATURES
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NAMES
    SMILES
    CCCC(=O)NCCC[C@@](O)(c1cccc(Cl)c1)[C@@H]1CCCN(C(=O)N[C@H](CNC)CC2CCCCC2)C1
    InChI
    InChI=1S/C30H49ClN4O3/c1-3-10-28(36)33-17-9-16-30(38,24-13-7-15-26(31)20-24)25-14-8-18-35(22-25)29(37)34-27(21-32-2)19-23-11-5-4-6-12-23/h7,13,15,20,23,25,27,32,38H,3-6,8-12,14,16-19,21-22H2,1-2H3,(H,33,36)(H,34,37)/t25-,27+,30-/m1/s1
    MOLECULAR FORMULA
    C30H49ClN4O3
    CROSS REFERENCES
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    canSAR649465

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 548.35
    AlogP 5.20
    HBond donors 4
    HBond acceptors 7
    Atoms 87
    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 canSAR649465.