canSAR1602838
FEATURES
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NAMES
    SMILES
    O=c1c2oc3nc4c(cc3c2ncn1CCCc1ccccc1)CCCC4
    InChI
    InChI=1S/C22H21N3O2/c26-22-20-19(17-13-16-10-4-5-11-18(16)24-21(17)27-20)23-14-25(22)12-6-9-15-7-2-1-3-8-15/h1-3,7-8,13-14H,4-6,9-12H2
    MOLECULAR FORMULA
    C22H21N3O2
    CROSS REFERENCES
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    canSAR1602838
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight359.16
    AlogP4.05
    HBond donors0
    HBond acceptors5
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1602838.