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canSAR1522853
FEATURES
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NAMES
    SMILES
    CCCC=Cc1ccc(CN2C(CC(C)C)C(=O)N(Cc3cn(Cc4ccco4)nn3)CCS2(=O)=O)cc1
    InChI
    InChI=1S/C28H37N5O4S/c1-4-5-6-8-23-10-12-24(13-11-23)18-33-27(17-22(2)3)28(34)31(14-16-38(33,35)36)19-25-20-32(30-29-25)21-26-9-7-15-37-26/h6-13,15,20,22,27H,4-5,14,16-19,21H2,1-3H3
    MOLECULAR FORMULA
    C28H37N5O4S
    CROSS REFERENCES
    1522853 logo

    canSAR1522853

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 539.26
    AlogP 4.32
    HBond donors 0
    HBond acceptors 9
    Atoms 75
    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 canSAR1522853.