canSAR1417361
FEATURES
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NAMES
    SMILES
    CCCOC(=O)NCc1cnc2c(ccn2-c2cc(NC(C)C)c(C(=O)NC[C@@H](F)C(C)(C)O)cn2)c1
    InChI
    InChI=1S/C26H35FN6O4/c1-6-9-37-25(35)31-13-17-10-18-7-8-33(23(18)29-12-17)22-11-20(32-16(2)3)19(14-28-22)24(34)30-15-21(27)26(4,5)36/h7-8,10-12,14,16,21,36H,6,9,13,15H2,1-5H3,(H,28,32)(H,30,34)(H,31,35)/t21-/m1/s1
    MOLECULAR FORMULA
    C26H35FN6O4
    CROSS REFERENCES
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    canSAR1417361
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight514.27
    AlogP3.72
    HBond donors4
    HBond acceptors10
    Atoms72
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417361.