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canSAR1616428
FEATURES
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NAMES
    SMILES
    COCCCNC(=O)CC1C[C@H](C(=O)N(C(C)C)C(C)C)[C@@]2(C)c3[nH]c4ccc(OC)cc4c3CCN2C1=O
    InChI
    InChI=1S/C30H44N4O5/c1-18(2)34(19(3)4)29(37)24-15-20(16-26(35)31-12-8-14-38-6)28(36)33-13-11-22-23-17-21(39-7)9-10-25(23)32-27(22)30(24,33)5/h9-10,17-20,24,32H,8,11-16H2,1-7H3,(H,31,35)/t20?,24-,30+/m1/s1
    MOLECULAR FORMULA
    C30H44N4O5
    CROSS REFERENCES
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    canSAR1616428

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 540.33
    AlogP 3.60
    HBond donors 2
    HBond acceptors 9
    Atoms 83
    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 canSAR1616428.