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canSAR1648515
FEATURES
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NAMES
    SMILES
    O=C(NCCCN1CCOCC1)c1ccc2c(c1)N(Cc1ccccc1)CCS2
    InChI
    InChI=1S/C23H29N3O2S/c27-23(24-9-4-10-25-11-14-28-15-12-25)20-7-8-22-21(17-20)26(13-16-29-22)18-19-5-2-1-3-6-19/h1-3,5-8,17H,4,9-16,18H2,(H,24,27)
    MOLECULAR FORMULA
    C23H29N3O2S
    CROSS REFERENCES
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    canSAR1648515

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.20
    AlogP 3.25
    HBond donors 1
    HBond acceptors 5
    Atoms 58
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1648515.