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canSAR783461
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NAMES
    SMILES
    CC(=O)N[C@@]1(C)[C@H](OC(C)=O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3[C@@H](C)[C@H](C)CC[C@]3(C)CC[C@]21C
    InChI
    InChI=1S/C33H51NO4/c1-19-10-13-29(5)16-17-31(7)23(27(29)20(19)2)18-24(37)28-30(6)14-12-26(38-22(4)36)33(9,34-21(3)35)25(30)11-15-32(28,31)8/h18-20,25-28H,10-17H2,1-9H3,(H,34,35)/t19-,20+,25-,26-,27+,28-,29-,30+,31-,32-,33-/m1/s1
    MOLECULAR FORMULA
    C33H51NO4
    CROSS REFERENCES
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    canSAR783461

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 525.38
    AlogP 6.64
    HBond donors 1
    HBond acceptors 5
    Atoms 89
    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 canSAR783461.