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canSAR1014804
FEATURES
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NAMES
    SMILES
    N#Cc1cccc(/N=N/c2c(Cl)nc(N)nc2N[C@@H]2C[C@H](CO)[C@@H](O)[C@H]2O)c1
    InChI
    InChI=1S/C17H18ClN7O3/c18-15-12(25-24-10-3-1-2-8(4-10)6-19)16(23-17(20)22-15)21-11-5-9(7-26)13(27)14(11)28/h1-4,9,11,13-14,26-28H,5,7H2,(H3,20,21,22,23)/b25-24+/t9-,11-,13-,14+/m1/s1
    MOLECULAR FORMULA
    C17H18ClN7O3
    CROSS REFERENCES
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    canSAR1014804

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.12
    AlogP 1.51
    HBond donors 6
    HBond acceptors 10
    Atoms 46
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1014804.