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canSAR343120
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NAMES
    SMILES
    N#Cc1ccc2[nH]cc(CCCCN3CCN(c4ccc5c(c4)CC(C(N)=O)O5)CC3)c2c1
    InChI
    InChI=1S/C26H29N5O2/c27-16-18-4-6-23-22(13-18)19(17-29-23)3-1-2-8-30-9-11-31(12-10-30)21-5-7-24-20(14-21)15-25(33-24)26(28)32/h4-7,13-14,17,25,29H,1-3,8-12,15H2,(H2,28,32)
    MOLECULAR FORMULA
    C26H29N5O2
    CROSS REFERENCES
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    canSAR343120

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.23
    AlogP 2.97
    HBond donors 3
    HBond acceptors 7
    Atoms 62
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR343120.