canSAR1583409
FEATURES
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NAMES
    SMILES
    C[C@@H](CO)N1C[C@@H](C)[C@H](CN(C)S(=O)(=O)c2ccc3c(c2)OCCCO3)OCc2cn(nn2)CCCC1=O
    InChI
    InChI=1S/C25H37N5O7S/c1-18-13-30(19(2)16-31)25(32)6-4-9-29-14-20(26-27-29)17-37-24(18)15-28(3)38(33,34)21-7-8-22-23(12-21)36-11-5-10-35-22/h7-8,12,14,18-19,24,31H,4-6,9-11,13,15-17H2,1-3H3/t18-,19+,24+/m1/s1
    MOLECULAR FORMULA
    C25H37N5O7S
    CROSS REFERENCES
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    canSAR1583409
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight551.24
    AlogP1.28
    HBond donors1
    HBond acceptors12
    Atoms75
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1583409.