canSAR1503632
FEATURES
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NAMES
    SMILES
    Cl.O=C(c1cc2c(s1)CCCC2)N1CCN(Cc2ccc3c(c2)OCO3)CC1
    InChI
    InChI=1S/C21H24N2O3S.ClH/c24-21(20-12-16-3-1-2-4-19(16)27-20)23-9-7-22(8-10-23)13-15-5-6-17-18(11-15)26-14-25-17;/h5-6,11-12H,1-4,7-10,13-14H2;1H
    MOLECULAR FORMULA
    C21H25ClN2O3S
    CROSS REFERENCES
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    canSAR1503632
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight420.13
    AlogP3.74
    HBond donors0
    HBond acceptors5
    Atoms53
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1503632.