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canSAR1130482
FEATURES
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NAMES
    SMILES
    Nc1ncnc2c1C(=O)N(c1ccc([C@H]3CC[C@H](CCC(=O)O)CC3)cc1)CCO2
    InChI
    InChI=1S/C22H26N4O4/c23-20-19-21(25-13-24-20)30-12-11-26(22(19)29)17-8-6-16(7-9-17)15-4-1-14(2-5-15)3-10-18(27)28/h6-9,13-15H,1-5,10-12H2,(H,27,28)(H2,23,24,25)/t14-,15-
    MOLECULAR FORMULA
    C22H26N4O4
    CROSS REFERENCES
    1130482 logo

    canSAR1130482

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 410.20
    AlogP 3.24
    HBond donors 3
    HBond acceptors 8
    Atoms 56
    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 canSAR1130482.