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canSAR16468
FEATURES
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NAMES
    SMILES
    O=C(NCc1cc(F)ccc1F)Nc1ccc(S(=O)(=O)N2CCC(CNC[C@H](O)COc3ccc(O)c(F)c3)CC2)cc1
    InChI
    InChI=1S/C29H33F3N4O6S/c30-21-1-7-26(31)20(13-21)16-34-29(39)35-22-2-5-25(6-3-22)43(40,41)36-11-9-19(10-12-36)15-33-17-23(37)18-42-24-4-8-28(38)27(32)14-24/h1-8,13-14,19,23,33,37-38H,9-12,15-18H2,(H2,34,35,39)/t23-/m0/s1
    MOLECULAR FORMULA
    C29H33F3N4O6S
    CROSS REFERENCES
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    canSAR16468

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 622.21
    AlogP 3.56
    HBond donors 5
    HBond acceptors 10
    Atoms 76
    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 canSAR16468.