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canSAR91540
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NAMES
    SMILES
    Clc1ccc(CNCC[C@@H]2C[C@H]2c2c[nH]cn2)cc1
    InChI
    InChI=1S/C15H18ClN3/c16-13-3-1-11(2-4-13)8-17-6-5-12-7-14(12)15-9-18-10-19-15/h1-4,9-10,12,14,17H,5-8H2,(H,18,19)/t12-,14-/m1/s1
    MOLECULAR FORMULA
    C15H18ClN3
    CROSS REFERENCES
    91540 logo

    canSAR91540

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 275.12
    AlogP 3.35
    HBond donors 2
    HBond acceptors 3
    Atoms 37
    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 canSAR91540.