1727519 logo
canSAR1727519
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc2c(c1)CCN(C(=O)CNC[C@@H](C)O)C2C1CCCCC1
    InChI
    InChI=1S/C21H32N2O3/c1-15(24)13-22-14-20(25)23-11-10-17-12-18(26-2)8-9-19(17)21(23)16-6-4-3-5-7-16/h8-9,12,15-16,21-22,24H,3-7,10-11,13-14H2,1-2H3/t15-,21?/m1/s1
    MOLECULAR FORMULA
    C21H32N2O3
    CROSS REFERENCES
    1727519 logo

    canSAR1727519

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.24
    AlogP 2.67
    HBond donors 2
    HBond acceptors 5
    Atoms 58
    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 canSAR1727519.