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canSAR461904
FEATURES
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NAMES
    SMILES
    CCCCCCCCCCCCCCCCOC(=O)C1=C[C@H](NC(=N)N)[C@@H](NC(C)=O)[C@H]([C@H](OC)[C@H](O)CO)O1
    InChI
    InChI=1S/C29H54N4O7/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-39-28(37)24-19-22(33-29(30)31)25(32-21(2)35)27(40-24)26(38-3)23(36)20-34/h19,22-23,25-27,34,36H,4-18,20H2,1-3H3,(H,32,35)(H4,30,31,33)/t22-,23+,25+,26+,27+/m0/s1
    MOLECULAR FORMULA
    C29H54N4O7
    CROSS REFERENCES
    461904 logo

    canSAR461904

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 570.40
    AlogP 3.02
    HBond donors 7
    HBond acceptors 11
    Atoms 94
    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 canSAR461904.