canSAR823983
FEATURES
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NAMES
    SMILES
    O=C(Cn1c2ccccc2c2nc3ccccc3nc21)N1N=C(c2cc3ccccc3o2)CC1c1ccccc1[N+](=O)[O-]
    InChI
    InChI=1S/C33H22N6O4/c40-31(19-37-26-14-6-3-11-22(26)32-33(37)35-24-13-5-4-12-23(24)34-32)38-28(21-10-2-7-15-27(21)39(41)42)18-25(36-38)30-17-20-9-1-8-16-29(20)43-30/h1-17,28H,18-19H2
    MOLECULAR FORMULA
    C33H22N6O4
    CROSS REFERENCES
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    canSAR823983
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight566.17
    AlogP6.77
    HBond donors0
    HBond acceptors10
    Atoms65
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR823983.