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canSAR1372513
FEATURES
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NAMES
    SMILES
    CCc1cc2nc3c(=O)[nH]c(=O)nc-3n(CCN(CCO)CCO)c2cc1CC.Cl
    InChI
    InChI=1S/C20H27N5O4.ClH/c1-3-13-11-15-16(12-14(13)4-2)25(6-5-24(7-9-26)8-10-27)18-17(21-15)19(28)23-20(29)22-18;/h11-12,26-27H,3-10H2,1-2H3,(H,23,28,29);1H
    MOLECULAR FORMULA
    C20H28ClN5O4
    CROSS REFERENCES
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    canSAR1372513

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 437.18
    AlogP 0.42
    HBond donors 3
    HBond acceptors 9
    Atoms 58
    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 canSAR1372513.