1998964 logo
canSAR1998964
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(O)c1cccc(Nc2nc3cc(-c4nnn[nH]4)ccc3c3sccc23)c1
    InChI
    InChI=1S/C19H12N6O2S/c26-19(27)11-2-1-3-12(8-11)20-18-14-6-7-28-16(14)13-5-4-10(9-15(13)21-18)17-22-24-25-23-17/h1-9H,(H,20,21)(H,26,27)(H,22,23,24,25)
    MOLECULAR FORMULA
    C19H12N6O2S
    CROSS REFERENCES
    1998964 logo

    canSAR1998964

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 388.07
    AlogP 4.07
    HBond donors 3
    HBond acceptors 8
    Atoms 40
    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 canSAR1998964.