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canSAR1989220
FEATURES
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NAMES
    SMILES
    COc1ccc(-n2c(=S)[nH]c3cc(C(=O)N4CCN(c5ccccc5)CC4)ccc3c2=O)c(OC)c1
    InChI
    InChI=1S/C27H26N4O4S/c1-34-20-9-11-23(24(17-20)35-2)31-26(33)21-10-8-18(16-22(21)28-27(31)36)25(32)30-14-12-29(13-15-30)19-6-4-3-5-7-19/h3-11,16-17H,12-15H2,1-2H3,(H,28,36)
    MOLECULAR FORMULA
    C27H26N4O4S
    CROSS REFERENCES
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    canSAR1989220

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 502.17
    AlogP 4.03
    HBond donors 1
    HBond acceptors 8
    Atoms 62
    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 canSAR1989220.