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canSAR1859364
FEATURES
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NAMES
    SMILES
    C[C@]12c3[nH]c4ccccc4c3CCN1C(=O)C(CC(=O)NCCC1=CCCCC1)C[C@@H]2C(=O)N1CCCCC1
    InChI
    InChI=1S/C32H42N4O3/c1-32-26(31(39)35-17-8-3-9-18-35)20-23(21-28(37)33-16-14-22-10-4-2-5-11-22)30(38)36(32)19-15-25-24-12-6-7-13-27(24)34-29(25)32/h6-7,10,12-13,23,26,34H,2-5,8-9,11,14-21H2,1H3,(H,33,37)/t23?,26-,32+/m1/s1
    MOLECULAR FORMULA
    C32H42N4O3
    CROSS REFERENCES
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    canSAR1859364

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 530.33
    AlogP 4.81
    HBond donors 2
    HBond acceptors 7
    Atoms 81
    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 canSAR1859364.