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canSAR833097
FEATURES
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NAMES
    SMILES
    O=C(Nc1ccncn1)c1cc2c(OCC[C@@H]3CCCCN3)c(-c3cc(Cl)cc(Cl)c3)c(O)nc2cc1Cl
    InChI
    InChI=1S/C27H24Cl3N5O3/c28-16-9-15(10-17(29)11-16)24-25(38-8-5-18-3-1-2-6-32-18)20-12-19(21(30)13-22(20)34-27(24)37)26(36)35-23-4-7-31-14-33-23/h4,7,9-14,18,32H,1-3,5-6,8H2,(H,34,37)(H,31,33,35,36)/t18-/m0/s1
    MOLECULAR FORMULA
    C27H24Cl3N5O3
    CROSS REFERENCES
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    canSAR833097

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 571.09
    AlogP 6.52
    HBond donors 3
    HBond acceptors 8
    Atoms 62
    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 canSAR833097.