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canSAR1526164
FEATURES
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NAMES
    SMILES
    Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)CC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)[C@@H](O)[C@H]1O
    InChI
    InChI=1S/C21H30N7O8PS/c22-18-15-19(24-8-23-18)28(9-25-15)20-17(31)16(30)12(36-20)5-35-37(33,34)6-10(29)3-1-2-4-13-14-11(7-38-13)26-21(32)27-14/h8-9,11-14,16-17,20,30-31H,1-7H2,(H,33,34)(H2,22,23,24)(H2,26,27,32)/t11-,12+,13-,14-,16+,17+,20+/m0/s1
    MOLECULAR FORMULA
    C21H30N7O8PS
    CROSS REFERENCES
    1526164 logo

    canSAR1526164

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 571.16
    AlogP -0.48
    HBond donors 7
    HBond acceptors 15
    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 canSAR1526164.