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canSAR199282
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NAMES
    SMILES
    CCCCC(Sc1nc(NC)c2cnn(-c3ccccc3)c2n1)C(N)=O
    InChI
    InChI=1S/C18H22N6OS/c1-3-4-10-14(15(19)25)26-18-22-16(20-2)13-11-21-24(17(13)23-18)12-8-6-5-7-9-12/h5-9,11,14H,3-4,10H2,1-2H3,(H2,19,25)(H,20,22,23)
    MOLECULAR FORMULA
    C18H22N6OS
    CROSS REFERENCES
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    canSAR199282

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 370.16
    AlogP 2.99
    HBond donors 3
    HBond acceptors 7
    Atoms 48
    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 canSAR199282.