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canSAR1986979
FEATURES
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NAMES
    SMILES
    O=C(c1ccc(Cn2c(=S)[nH]c3ccc(N4CCOCC4)cc3c2=O)cc1)N1CCC(N2CCCCC2)CC1
    InChI
    InChI=1S/C30H37N5O3S/c36-28(34-14-10-24(11-15-34)32-12-2-1-3-13-32)23-6-4-22(5-7-23)21-35-29(37)26-20-25(33-16-18-38-19-17-33)8-9-27(26)31-30(35)39/h4-9,20,24H,1-3,10-19,21H2,(H,31,39)
    MOLECULAR FORMULA
    C30H37N5O3S
    CROSS REFERENCES
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    canSAR1986979

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 547.26
    AlogP 4.03
    HBond donors 1
    HBond acceptors 8
    Atoms 76
    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 canSAR1986979.