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canSAR1108178
FEATURES
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NAMES
    SMILES
    NCCCOc1cc(OCCCN)cc(-c2cc(NC(=O)c3ccc4ccccc4c3)cc(-c3cc(OCCCN)cc(OCCCN)c3)c2)c1
    InChI
    InChI=1S/C41H49N5O5/c42-11-3-15-48-37-23-34(24-38(27-37)49-16-4-12-43)32-20-33(35-25-39(50-17-5-13-44)28-40(26-35)51-18-6-14-45)22-36(21-32)46-41(47)31-10-9-29-7-1-2-8-30(29)19-31/h1-2,7-10,19-28H,3-6,11-18,42-45H2,(H,46,47)
    MOLECULAR FORMULA
    C41H49N5O5
    CROSS REFERENCES
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    canSAR1108178

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 691.37
    AlogP 6.34
    HBond donors 9
    HBond acceptors 10
    Atoms 100
    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 canSAR1108178.