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canSAR1832960
FEATURES
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NAMES
    SMILES
    CCCCC[C@@H]1[C@H]2[C@H]3C(=O)N(c4ccccc4)C(=O)[C@H]3CC(=O)[C@H]2[C@H](c2ccccc2)N1S(=O)(=O)c1ccc(C)cc1
    InChI
    InChI=1S/C34H36N2O5S/c1-3-4-7-16-27-30-29-26(33(38)35(34(29)39)24-14-10-6-11-15-24)21-28(37)31(30)32(23-12-8-5-9-13-23)36(27)42(40,41)25-19-17-22(2)18-20-25/h5-6,8-15,17-20,26-27,29-32H,3-4,7,16,21H2,1-2H3/t26-,27+,29-,30-,31+,32-/m0/s1
    MOLECULAR FORMULA
    C34H36N2O5S
    CROSS REFERENCES
    1832960 logo

    canSAR1832960

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 584.23
    AlogP 5.70
    HBond donors 0
    HBond acceptors 7
    Atoms 78
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1832960.