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canSAR1024950
FEATURES
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NAMES
    SMILES
    CC[C@@H](Cc1ccccc1)Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C20H23N5O5/c1-2-12(8-11-6-4-3-5-7-11)24-17-13-18(22-9-21-17)25(10-23-13)19-15(27)14(26)16(30-19)20(28)29/h3-7,9-10,12,14-16,19,26-27H,2,8H2,1H3,(H,28,29)(H,21,22,24)/t12-,14-,15+,16-,19+/m0/s1
    MOLECULAR FORMULA
    C20H23N5O5
    CROSS REFERENCES
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    canSAR1024950

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 413.17
    AlogP 0.96
    HBond donors 4
    HBond acceptors 10
    Atoms 53
    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 canSAR1024950.