canSAR1020679
FEATURES
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NAMES
    SMILES
    CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)c1ccc2c(c1)C(=CN)C(=O)N2
    InChI
    InChI=1S/C30H38N4O8S/c1-18(2)15-34(43(38,39)20-8-9-24-22(13-20)23(14-31)28(36)32-24)16-26(35)25(12-19-6-4-3-5-7-19)33-30(37)42-27-17-41-29-21(27)10-11-40-29/h3-9,13-14,18,21,25-27,29,35H,10-12,15-17,31H2,1-2H3,(H,32,36)(H,33,37)/t21-,25-,26+,27-,29+/m0/s1
    MOLECULAR FORMULA
    C30H38N4O8S
    CROSS REFERENCES
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    canSAR1020679
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight614.24
    AlogP2.04
    HBond donors5
    HBond acceptors12
    Atoms81
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1020679.