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canSAR398914
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NAMES
    SMILES
    C=CCNC(=O)C1(N(CCCn2ccnc2)C(=O)c2cccnc2)CCCc2cc(OC)ccc21
    InChI
    InChI=1S/C27H31N5O3/c1-3-12-30-26(34)27(11-4-7-21-18-23(35-2)9-10-24(21)27)32(16-6-15-31-17-14-29-20-31)25(33)22-8-5-13-28-19-22/h3,5,8-10,13-14,17-20H,1,4,6-7,11-12,15-16H2,2H3,(H,30,34)
    MOLECULAR FORMULA
    C27H31N5O3
    CROSS REFERENCES
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    canSAR398914

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 473.24
    AlogP 3.35
    HBond donors 1
    HBond acceptors 8
    Atoms 66
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR398914.