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canSAR563331
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NAMES
    SMILES
    COc1cc2nc(N(C)CCCNC(=O)c3ccco3)nc(N)c2cc1OC.Cl
    InChI
    InChI=1S/C19H23N5O4.ClH/c1-24(8-5-7-21-18(25)14-6-4-9-28-14)19-22-13-11-16(27-3)15(26-2)10-12(13)17(20)23-19;/h4,6,9-11H,5,7-8H2,1-3H3,(H,21,25)(H2,20,22,23);1H
    MOLECULAR FORMULA
    C19H24ClN5O4
    CROSS REFERENCES
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    canSAR563331

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 421.15
    AlogP 2.50
    HBond donors 3
    HBond acceptors 9
    Atoms 53
    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 canSAR563331.