canSAR1632080
FEATURES
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NAMES
    SMILES
    O=C1Nc2ccccc2[C@@]12N1CCC[C@@H]1[C@@H](c1ccc(C(F)(F)F)cc1)[C@@]21N=C(c2ccccc2)OC1=O
    InChI
    InChI=1S/C29H22F3N3O3/c30-29(31,32)19-14-12-17(13-15-19)23-22-11-6-16-35(22)28(20-9-4-5-10-21(20)33-25(28)36)27(23)26(37)38-24(34-27)18-7-2-1-3-8-18/h1-5,7-10,12-15,22-23H,6,11,16H2,(H,33,36)/t22-,23-,27+,28-/m1/s1
    MOLECULAR FORMULA
    C29H22F3N3O3
    CROSS REFERENCES
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    canSAR1632080
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight517.16
    AlogP4.86
    HBond donors1
    HBond acceptors6
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1632080.