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canSAR2019383
FEATURES
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NAMES
    SMILES
    CC1CCC(NC(=O)C2CCN(S(=O)(=O)c3ccc4nc5c(c(C(=O)O)c4c3)CC(C)CC5)CC2)CC1
    InChI
    InChI=1S/C28H37N3O5S/c1-17-3-6-20(7-4-17)29-27(32)19-11-13-31(14-12-19)37(35,36)21-8-10-25-23(16-21)26(28(33)34)22-15-18(2)5-9-24(22)30-25/h8,10,16-20H,3-7,9,11-15H2,1-2H3,(H,29,32)(H,33,34)
    MOLECULAR FORMULA
    C28H37N3O5S
    CROSS REFERENCES
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    canSAR2019383

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 527.25
    AlogP 4.15
    HBond donors 2
    HBond acceptors 8
    Atoms 74
    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 canSAR2019383.