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canSAR1018327
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NAMES
    SMILES
    CCC1CCCCN1CC(=O)N1N=C(c2cc3ccccc3oc2=O)CC1c1ccccc1
    InChI
    InChI=1S/C27H29N3O3/c1-2-21-13-8-9-15-29(21)18-26(31)30-24(19-10-4-3-5-11-19)17-23(28-30)22-16-20-12-6-7-14-25(20)33-27(22)32/h3-7,10-12,14,16,21,24H,2,8-9,13,15,17-18H2,1H3
    MOLECULAR FORMULA
    C27H29N3O3
    CROSS REFERENCES
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    canSAR1018327

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.22
    AlogP 4.74
    HBond donors 0
    HBond acceptors 6
    Atoms 62
    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 canSAR1018327.