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canSAR346884
FEATURES
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NAMES
    SMILES
    CCNC(=O)C(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@@H](NC(=O)CCCC1CCCS1)C(C)C
    InChI
    InChI=1S/C25H36ClN3O4S/c1-4-27-25(33)23(31)20(15-17-10-12-18(26)13-11-17)28-24(32)22(16(2)3)29-21(30)9-5-7-19-8-6-14-34-19/h10-13,16,19-20,22H,4-9,14-15H2,1-3H3,(H,27,33)(H,28,32)(H,29,30)/t19?,20-,22-/m0/s1
    MOLECULAR FORMULA
    C25H36ClN3O4S
    CROSS REFERENCES
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    canSAR346884

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 509.21
    AlogP 3.28
    HBond donors 3
    HBond acceptors 7
    Atoms 70
    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 canSAR346884.