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canSAR1402791
FEATURES
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NAMES
    SMILES
    CCN1C(=O)[C@H]2CC[C@H]3/C(=N\O[C@@H](C)c4cn([C@H](CO)Cc5ccccc5)nn4)C[C@@H](O)[C@@H](O)[C@@H]3[C@@H]2C1=O
    InChI
    InChI=1S/C27H35N5O6/c1-3-31-26(36)19-10-9-18-20(12-22(34)25(35)23(18)24(19)27(31)37)29-38-15(2)21-13-32(30-28-21)17(14-33)11-16-7-5-4-6-8-16/h4-8,13,15,17-19,22-25,33-35H,3,9-12,14H2,1-2H3/b29-20-/t15-,17-,18-,19-,22+,23-,24+,25+/m0/s1
    MOLECULAR FORMULA
    C27H35N5O6
    CROSS REFERENCES
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    canSAR1402791

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 525.26
    AlogP 1.26
    HBond donors 3
    HBond acceptors 11
    Atoms 73
    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 canSAR1402791.