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canSAR743311
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NAMES
    SMILES
    Cl.N#CC(CCCNC(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
    InChI
    InChI=1S/C30H28N2.ClH/c31-24-30(27-18-9-3-10-19-27,28-20-11-4-12-21-28)22-13-23-32-29(25-14-5-1-6-15-25)26-16-7-2-8-17-26;/h1-12,14-21,29,32H,13,22-23H2;1H
    MOLECULAR FORMULA
    C30H29ClN2
    CROSS REFERENCES
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    canSAR743311

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.20
    AlogP 7.08
    HBond donors 1
    HBond acceptors 2
    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 canSAR743311.