canSAR598140
FEATURES
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NAMES
    SMILES
    O=c1c(-c2ccccc2)c(SCc2ccncc2)oc2cc(OCC3CCCCC3)ccc12
    InChI
    InChI=1S/C28H27NO3S/c30-27-24-12-11-23(31-18-20-7-3-1-4-8-20)17-25(24)32-28(26(27)22-9-5-2-6-10-22)33-19-21-13-15-29-16-14-21/h2,5-6,9-17,20H,1,3-4,7-8,18-19H2
    MOLECULAR FORMULA
    C28H27NO3S
    CROSS REFERENCES
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    canSAR598140
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight457.17
    AlogP7.11
    HBond donors0
    HBond acceptors4
    Atoms60
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR598140.