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canSAR789946
FEATURES
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NAMES
    SMILES
    OC[C@H]1O[C@@H](Sc2nc3sc4c(c3c(=S)[nH]2)CCCC4)[C@@H](O)[C@@H]1O
    InChI
    InChI=1S/C15H18N2O4S3/c18-5-7-10(19)11(20)14(21-7)24-15-16-12(22)9-6-3-1-2-4-8(6)23-13(9)17-15/h7,10-11,14,18-20H,1-5H2,(H,16,17,22)/t7-,10-,11+,14+/m1/s1
    MOLECULAR FORMULA
    C15H18N2O4S3
    CROSS REFERENCES
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    canSAR789946

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 386.04
    AlogP 1.76
    HBond donors 4
    HBond acceptors 6
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR789946.