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canSAR1965879
FEATURES
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NAMES
    SMILES
    Clc1cc([C@H]2CNCCO2)ccc1Nc1ncc(C2CC2)cn1
    InChI
    InChI=1S/C17H19ClN4O/c18-14-7-12(16-10-19-5-6-23-16)3-4-15(14)22-17-20-8-13(9-21-17)11-1-2-11/h3-4,7-9,11,16,19H,1-2,5-6,10H2,(H,20,21,22)/t16-/m1/s1
    MOLECULAR FORMULA
    C17H19ClN4O
    CROSS REFERENCES
    1965879 logo

    canSAR1965879

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 330.12
    AlogP 3.41
    HBond donors 2
    HBond acceptors 5
    Atoms 42
    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 canSAR1965879.