canSAR1601838
FEATURES
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NAMES
    SMILES
    CCc1nc2ccc(C(=O)NCCCn3ccnc3)cn2c1N(CC)CCOC
    InChI
    InChI=1S/C21H30N6O2/c1-4-18-21(26(5-2)13-14-29-3)27-15-17(7-8-19(27)24-18)20(28)23-9-6-11-25-12-10-22-16-25/h7-8,10,12,15-16H,4-6,9,11,13-14H2,1-3H3,(H,23,28)
    MOLECULAR FORMULA
    C21H30N6O2
    CROSS REFERENCES
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    canSAR1601838
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight398.24
    AlogP2.39
    HBond donors1
    HBond acceptors8
    Atoms59
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1601838.