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canSAR1144647
FEATURES
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NAMES
    SMILES
    CCCC(NC(=O)C1CCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NCCF
    InChI
    InChI=1S/C31H46FN7O6/c1-5-9-20(24(40)29(44)35-14-13-32)36-27(42)22-12-17-39(22)30(45)25(31(2,3)4)38-28(43)23(19-10-7-6-8-11-19)37-26(41)21-18-33-15-16-34-21/h15-16,18-20,22-23,25H,5-14,17H2,1-4H3,(H,35,44)(H,36,42)(H,37,41)(H,38,43)/t20?,22?,23-,25+/m0/s1
    MOLECULAR FORMULA
    C31H46FN7O6
    CROSS REFERENCES
    1144647 logo

    canSAR1144647

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 631.35
    AlogP 1.23
    HBond donors 4
    HBond acceptors 13
    Atoms 91
    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 canSAR1144647.