canSAR2095359
FEATURES
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NAMES
    SMILES
    Cc1c(/C=N/N2C=Nc3c([nH]c4ccccc34)C2)c(=O)oc2c3c4c(cc12)CCCN4CCC3
    InChI
    InChI=1S/C27H25N5O2/c1-16-20-12-17-6-4-10-31-11-5-8-19(25(17)31)26(20)34-27(33)21(16)13-29-32-14-23-24(28-15-32)18-7-2-3-9-22(18)30-23/h2-3,7,9,12-13,15,30H,4-6,8,10-11,14H2,1H3/b29-13+
    MOLECULAR FORMULA
    C27H25N5O2
    CROSS REFERENCES
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    canSAR2095359
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight451.20
    AlogP4.79
    HBond donors1
    HBond acceptors7
    Atoms59
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2095359.