163653 logo
canSAR163653
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NCCN1CCC(Cc2c[nH]cn2)CC1)c1ccc(Cl)cc1
    InChI
    InChI=1S/C18H23ClN4O/c19-16-3-1-15(2-4-16)18(24)21-7-10-23-8-5-14(6-9-23)11-17-12-20-13-22-17/h1-4,12-14H,5-11H2,(H,20,22)(H,21,24)
    MOLECULAR FORMULA
    C18H23ClN4O
    CROSS REFERENCES
    163653 logo

    canSAR163653

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 346.16
    AlogP 2.75
    HBond donors 2
    HBond acceptors 5
    Atoms 47
    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 canSAR163653.