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canSAR1835215
FEATURES
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NAMES
    SMILES
    CC(Sc1nnc(-c2ccco2)n1-c1ccccc1)C(=O)NCC1CCCO1
    InChI
    InChI=1S/C20H22N4O3S/c1-14(19(25)21-13-16-9-5-11-26-16)28-20-23-22-18(17-10-6-12-27-17)24(20)15-7-3-2-4-8-15/h2-4,6-8,10,12,14,16H,5,9,11,13H2,1H3,(H,21,25)
    MOLECULAR FORMULA
    C20H22N4O3S
    CROSS REFERENCES
    1835215 logo

    canSAR1835215

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 398.14
    AlogP 3.30
    HBond donors 1
    HBond acceptors 7
    Atoms 50
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1835215.