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canSAR986548
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCCCC(=O)O)NC(=O)[C@H]2CCCCN2CC1=O
    InChI
    InChI=1S/C34H49N5O7/c1-4-22(2)31-29(40)21-38-18-12-11-16-28(38)34(45)35-25(14-7-5-6-8-17-30(41)42)32(43)36-26(33(44)37-31)19-23-20-39(46-3)27-15-10-9-13-24(23)27/h9-10,13,15,20,22,25-26,28,31H,4-8,11-12,14,16-19,21H2,1-3H3,(H,35,45)(H,36,43)(H,37,44)(H,41,42)/t22-,25-,26-,28+,31-/m0/s1
    MOLECULAR FORMULA
    C34H49N5O7
    CROSS REFERENCES
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    canSAR986548

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 639.36
    AlogP 2.61
    HBond donors 4
    HBond acceptors 12
    Atoms 95
    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 canSAR986548.