canSAR2163409
FEATURES
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NAMES
    SMILES
    Cc1cccnc1-n1c(Cn2nc(-c3ccc4oc(N)nc4c3)c3c(N)ncnc32)cc2cccc(C)c2c1=O
    InChI
    InChI=1S/C29H23N9O2/c1-15-5-3-7-17-11-19(38(28(39)22(15)17)26-16(2)6-4-10-32-26)13-37-27-23(25(30)33-14-34-27)24(36-37)18-8-9-21-20(12-18)35-29(31)40-21/h3-12,14H,13H2,1-2H3,(H2,31,35)(H2,30,33,34)
    MOLECULAR FORMULA
    C29H23N9O2
    CROSS REFERENCES
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    canSAR2163409
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight529.20
    AlogP4.16
    HBond donors4
    HBond acceptors11
    Atoms63
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2163409.