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canSAR171795
FEATURES
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NAMES
    SMILES
    CC(C)CCC[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)c1cnc2ccccc2n1)C(N)=O
    InChI
    InChI=1S/C27H34N4O3/c1-18(2)9-8-12-20(26(28)33)16-25(32)23(15-19-10-4-3-5-11-19)31-27(34)24-17-29-21-13-6-7-14-22(21)30-24/h3-7,10-11,13-14,17-18,20,23,25,32H,8-9,12,15-16H2,1-2H3,(H2,28,33)(H,31,34)/t20-,23+,25+/m1/s1
    MOLECULAR FORMULA
    C27H34N4O3
    CROSS REFERENCES
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    canSAR171795

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 462.26
    AlogP 3.65
    HBond donors 4
    HBond acceptors 7
    Atoms 68
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR171795.