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canSAR1828969
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NAMES
    SMILES
    OC(c1cc(C23CC4CC(CC(C4)C2)C3)nc2c(Cl)cc(Cl)cc12)C1CCCCN1
    InChI
    InChI=1S/C25H30Cl2N2O/c26-17-8-18-19(24(30)21-3-1-2-4-28-21)10-22(29-23(18)20(27)9-17)25-11-14-5-15(12-25)7-16(6-14)13-25/h8-10,14-16,21,24,28,30H,1-7,11-13H2
    MOLECULAR FORMULA
    C25H30Cl2N2O
    CROSS REFERENCES
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    canSAR1828969

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 444.17
    AlogP 6.18
    HBond donors 2
    HBond acceptors 3
    Atoms 60
    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 canSAR1828969.