canSAR419949
FEATURES
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NAMES
    SMILES
    CCOC(=O)/C=C/[C@H](CCC(N)=O)NC(=O)[C@@H](CC(=O)[C@@H](NC(=O)SC1CCCC1)C(C)C)Cc1ccc(F)cc1
    InChI
    InChI=1S/C30H42FN3O6S/c1-4-40-27(37)16-14-23(13-15-26(32)36)33-29(38)21(17-20-9-11-22(31)12-10-20)18-25(35)28(19(2)3)34-30(39)41-24-7-5-6-8-24/h9-12,14,16,19,21,23-24,28H,4-8,13,15,17-18H2,1-3H3,(H2,32,36)(H,33,38)(H,34,39)/b16-14+/t21-,23+,28+/m1/s1
    MOLECULAR FORMULA
    C30H42FN3O6S
    CROSS REFERENCES
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    canSAR419949
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight591.28
    AlogP4.22
    HBond donors4
    HBond acceptors9
    Atoms83
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR419949.