canSAR636587
FEATURES
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NAMES
    SMILES
    O=c1c2cc([N+](=O)[O-])ccc2oc2nc3n(c(=O)c12)CCCS3
    InChI
    InChI=1S/C14H9N3O5S/c18-11-8-6-7(17(20)21)2-3-9(8)22-12-10(11)13(19)16-4-1-5-23-14(16)15-12/h2-3,6H,1,4-5H2
    MOLECULAR FORMULA
    C14H9N3O5S
    CROSS REFERENCES
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    canSAR636587
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight331.03
    AlogP1.91
    HBond donors0
    HBond acceptors8
    Atoms32
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR636587.