canSAR1087419
FEATURES
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NAMES
    SMILES
    O=c1n(Cc2nc(-c3nccs3)cn2CCCCO)c2cnccc2n1C1CC1
    InChI
    InChI=1S/C20H22N6O2S/c27-9-2-1-8-24-12-15(19-22-7-10-29-19)23-18(24)13-25-17-11-21-6-5-16(17)26(20(25)28)14-3-4-14/h5-7,10-12,14,27H,1-4,8-9,13H2
    MOLECULAR FORMULA
    C20H22N6O2S
    CROSS REFERENCES
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    canSAR1087419
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight410.15
    AlogP2.67
    HBond donors1
    HBond acceptors8
    Atoms51
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087419.