canSAR214654
FEATURES
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NAMES
    SMILES
    CCCCc1nc2ccc(N3CCCCS3(=O)=O)cc2n1Cc1ccc(-c2ccccc2C(=O)O)cc1
    InChI
    InChI=1S/C29H31N3O4S/c1-2-3-10-28-30-26-16-15-23(32-17-6-7-18-37(32,35)36)19-27(26)31(28)20-21-11-13-22(14-12-21)24-8-4-5-9-25(24)29(33)34/h4-5,8-9,11-16,19H,2-3,6-7,10,17-18,20H2,1H3,(H,33,34)
    MOLECULAR FORMULA
    C29H31N3O4S
    CROSS REFERENCES
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    canSAR214654
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight517.20
    AlogP5.72
    HBond donors1
    HBond acceptors7
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR214654.