canSAR712996
FEATURES
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NAMES
    SMILES
    COC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1c(-c2c(OC)ccc(OC)c2[N+](=O)[O-])nc2sccn12
    InChI
    InChI=1S/C24H24N4O8S/c1-11-15(22(29)35-5)18(16(12(2)25-11)23(30)36-6)21-19(26-24-27(21)9-10-37-24)17-13(33-3)7-8-14(34-4)20(17)28(31)32/h7-10,18,25H,1-6H3
    MOLECULAR FORMULA
    C24H24N4O8S
    CROSS REFERENCES
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    canSAR712996
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight528.13
    AlogP3.57
    HBond donors1
    HBond acceptors12
    Atoms61
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR712996.