396969 logo
canSAR396969
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cccc(OC)c1-c1ccc(C[C@H](NC(=O)[C@@]2(C)CCCO2)C(=O)O)cc1
    InChI
    InChI=1S/C23H27NO6/c1-23(12-5-13-30-23)22(27)24-17(21(25)26)14-15-8-10-16(11-9-15)20-18(28-2)6-4-7-19(20)29-3/h4,6-11,17H,5,12-14H2,1-3H3,(H,24,27)(H,25,26)/t17-,23+/m0/s1
    MOLECULAR FORMULA
    C23H27NO6
    CROSS REFERENCES
    396969 logo

    canSAR396969

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.18
    AlogP 3.05
    HBond donors 2
    HBond acceptors 7
    Atoms 57
    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 canSAR396969.