canSAR726042
FEATURES
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NAMES
    SMILES
    O=[N+]([O-])c1ccc2c(c1)c(OCc1ccccc1)nn2CCCCCN1CCN(C/C=C/c2ccccc2)CC1
    InChI
    InChI=1S/C32H37N5O3/c38-37(39)29-16-17-31-30(25-29)32(40-26-28-13-6-2-7-14-28)33-36(31)20-9-3-8-18-34-21-23-35(24-22-34)19-10-15-27-11-4-1-5-12-27/h1-2,4-7,10-17,25H,3,8-9,18-24,26H2/b15-10+
    MOLECULAR FORMULA
    C32H37N5O3
    CROSS REFERENCES
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    canSAR726042
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight539.29
    AlogP6.02
    HBond donors0
    HBond acceptors8
    Atoms77
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR726042.