canSAR2170895
FEATURES
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NAMES
    SMILES
    O=C1CCCCN1c1ccc(N2CCc3c(-c4nc[nH]n4)nn(-c4ccc(Br)cc4)c3C2=O)cc1
    InChI
    InChI=1S/C25H22BrN7O2/c26-16-4-6-19(7-5-16)33-23-20(22(30-33)24-27-15-28-29-24)12-14-32(25(23)35)18-10-8-17(9-11-18)31-13-2-1-3-21(31)34/h4-11,15H,1-3,12-14H2,(H,27,28,29)
    MOLECULAR FORMULA
    C25H22BrN7O2
    CROSS REFERENCES
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    canSAR2170895
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight531.10
    AlogP4.14
    HBond donors1
    HBond acceptors9
    Atoms57
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2170895.