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canSAR1861989
FEATURES
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NAMES
    SMILES
    CCCn1c(=O)c2[nH]c(-c3ccc(C=CC(=O)NN4C(=O)C(C)=C(C)C4=O)cc3)nc2n(CCC)c1=O
    InChI
    InChI=1S/C26H28N6O5/c1-5-13-30-22-20(25(36)31(14-6-2)26(30)37)27-21(28-22)18-10-7-17(8-11-18)9-12-19(33)29-32-23(34)15(3)16(4)24(32)35/h7-12H,5-6,13-14H2,1-4H3,(H,27,28)(H,29,33)
    MOLECULAR FORMULA
    C26H28N6O5
    CROSS REFERENCES
    1861989 logo

    canSAR1861989

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 504.21
    AlogP 2.12
    HBond donors 2
    HBond acceptors 11
    Atoms 65
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1861989.