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canSAR1826953
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NAMES
    SMILES
    C[C@]12CCC3c4ccc(O)cc4CCC3C1CC[C@@H]2OS(N)(=O)=O
    InChI
    InChI=1S/C18H25NO4S/c1-18-9-8-14-13-5-3-12(20)10-11(13)2-4-15(14)16(18)6-7-17(18)23-24(19,21)22/h3,5,10,14-17,20H,2,4,6-9H2,1H3,(H2,19,21,22)/t14?,15?,16?,17-,18-/m0/s1
    MOLECULAR FORMULA
    C18H25NO4S
    CROSS REFERENCES
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    canSAR1826953

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.15
    AlogP 2.84
    HBond donors 3
    HBond acceptors 5
    Atoms 49
    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 canSAR1826953.