canSAR542562
FEATURES
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NAMES
    SMILES
    COc1cc2nc3c(c4c2c(c1OC)NCC4)Cc1cc(OCCCN)ccc1-3.Cl
    InChI
    InChI=1S/C23H25N3O3.ClH/c1-27-19-12-18-20-16(6-8-25-22(20)23(19)28-2)17-11-13-10-14(29-9-3-7-24)4-5-15(13)21(17)26-18;/h4-5,10,12,25H,3,6-9,11,24H2,1-2H3;1H
    MOLECULAR FORMULA
    C23H26ClN3O3
    CROSS REFERENCES
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    canSAR542562
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight427.17
    AlogP3.94
    HBond donors3
    HBond acceptors6
    Atoms56
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR542562.