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canSAR1103100
FEATURES
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NAMES
    SMILES
    COC(=O)CC(=O)Nc1ccc2c3c(n(CCCNC(=O)OC(C)(C)C)c(=O)c2c1)-c1ccccc1C3=O
    InChI
    InChI=1S/C28H29N3O7/c1-28(2,3)38-27(36)29-12-7-13-31-24-18-8-5-6-9-19(18)25(34)23(24)17-11-10-16(14-20(17)26(31)35)30-21(32)15-22(33)37-4/h5-6,8-11,14H,7,12-13,15H2,1-4H3,(H,29,36)(H,30,32)
    MOLECULAR FORMULA
    C28H29N3O7
    CROSS REFERENCES
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    canSAR1103100

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 519.20
    AlogP 3.63
    HBond donors 2
    HBond acceptors 10
    Atoms 67
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1103100.