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canSAR787594
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NAMES
    SMILES
    C=C1C2CCC3C4(C)CCCC(C)(CO)C4CC(OC(C)=O)C3(C2)C1O
    InChI
    InChI=1S/C22H34O4/c1-13-15-6-7-16-21(4)9-5-8-20(3,12-23)17(21)10-18(26-14(2)24)22(16,11-15)19(13)25/h15-19,23,25H,1,5-12H2,2-4H3/t15-,16+,17+,18+,19+,20-,21+,22-/m1/s1
    MOLECULAR FORMULA
    C22H34O4
    CROSS REFERENCES
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    canSAR787594

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 362.25
    AlogP 3.46
    HBond donors 2
    HBond acceptors 4
    Atoms 60
    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 canSAR787594.