1154738 logo
canSAR1154738
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=O)O[C@H]1CC[C@@]2(C)C(=CC=C3[C@@H]2CC[C@@]2(C)[C@H]3CC[C@@H]2[C@H](C)/C=C/[C@H](C)C(C)C)C1(C)C
    InChI
    InChI=1S/C32H50O2/c1-20(2)21(3)10-11-22(4)25-13-14-26-24-12-15-28-30(6,7)29(34-23(5)33)17-19-32(28,9)27(24)16-18-31(25,26)8/h10-12,15,20-22,25-27,29H,13-14,16-19H2,1-9H3/b11-10+/t21-,22+,25+,26-,27-,29-,31+,32+/m0/s1
    MOLECULAR FORMULA
    C32H50O2
    CROSS REFERENCES
    1154738 logo

    canSAR1154738

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 466.38
    AlogP 8.54
    HBond donors 0
    HBond acceptors 2
    Atoms 84
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1154738.