1149208 logo
canSAR1149208
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1cc(CCC(=O)c2sc(C)c3c2C[C@@H]2[C@H]3C2(C)C)cc(C)c1OC[C@@H](O)CO
    InChI
    InChI=1S/C25H32O4S/c1-13-8-16(9-14(2)23(13)29-12-17(27)11-26)6-7-20(28)24-18-10-19-22(25(19,4)5)21(18)15(3)30-24/h8-9,17,19,22,26-27H,6-7,10-12H2,1-5H3/t17-,19+,22+/m0/s1
    MOLECULAR FORMULA
    C25H32O4S
    CROSS REFERENCES
    1149208 logo

    canSAR1149208

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.20
    AlogP 4.52
    HBond donors 2
    HBond acceptors 4
    Atoms 62
    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 canSAR1149208.