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canSAR1025409
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NAMES
    SMILES
    Cc1ccc(NC[C@@]2(C)C[C@@H](O)CC(C)(C)C2)cc1S(N)(=O)=O
    InChI
    InChI=1S/C17H28N2O3S/c1-12-5-6-13(7-15(12)23(18,21)22)19-11-17(4)9-14(20)8-16(2,3)10-17/h5-7,14,19-20H,8-11H2,1-4H3,(H2,18,21,22)/t14-,17-/m0/s1
    MOLECULAR FORMULA
    C17H28N2O3S
    CROSS REFERENCES
    1025409 logo

    canSAR1025409

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 340.18
    AlogP 2.63
    HBond donors 4
    HBond acceptors 5
    Atoms 51
    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 canSAR1025409.