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canSAR1621083
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NAMES
    SMILES
    CO[C@]12CC[C@@]3(C[C@@H]1COCc1ccccc1F)[C@H]1Cc4ccc(O)c5c4[C@@]3(CC[N+]1(C)CC1CC1)[C@H]2O5
    InChI
    InChI=1S/C32H38FNO4/c1-34(17-20-7-8-20)14-13-31-27-21-9-10-25(35)28(27)38-29(31)32(36-2)12-11-30(31,26(34)15-21)16-23(32)19-37-18-22-5-3-4-6-24(22)33/h3-6,9-10,20,23,26,29H,7-8,11-19H2,1-2H3/p+1/t23-,26-,29-,30-,31+,32-,34?/m1/s1
    MOLECULAR FORMULA
    C32H39FNO4+
    CROSS REFERENCES
    1621083 logo

    canSAR1621083

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 520.29
    AlogP 5.12
    HBond donors 1
    HBond acceptors 5
    Atoms 77
    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 canSAR1621083.