840390 logo
canSAR840390
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CON(CCCc1ccc(N(CCCl)CCCl)cc1)[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O
    InChI
    InChI=1S/C19H30Cl2N2O5/c1-27-23(19-18(26)17(25)16(24)13-28-19)10-2-3-14-4-6-15(7-5-14)22(11-8-20)12-9-21/h4-7,16-19,24-26H,2-3,8-13H2,1H3/t16-,17+,18-,19-/m0/s1
    MOLECULAR FORMULA
    C19H30Cl2N2O5
    CROSS REFERENCES
    840390 logo

    canSAR840390

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 436.15
    AlogP 1.21
    HBond donors 3
    HBond acceptors 7
    Atoms 58
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR840390.