1861980 logo
canSAR1861980
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NCCCNc1nc2ccccc2[nH]1)c1cncc(Cl)c1
    InChI
    InChI=1S/C16H16ClN5O/c17-12-8-11(9-18-10-12)15(23)19-6-3-7-20-16-21-13-4-1-2-5-14(13)22-16/h1-2,4-5,8-10H,3,6-7H2,(H,19,23)(H2,20,21,22)
    MOLECULAR FORMULA
    C16H16ClN5O
    CROSS REFERENCES
    1861980 logo

    canSAR1861980

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 329.10
    AlogP 2.84
    HBond donors 3
    HBond acceptors 6
    Atoms 39
    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 canSAR1861980.