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canSAR1970255
FEATURES
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NAMES
    SMILES
    CN[C@H]1C[C@H]2C[C@@](c3cccc(O)c3)(C1)[C@H](C)CN2CCCc1ccccc1.Cl
    InChI
    InChI=1S/C25H34N2O.ClH/c1-19-18-27(13-7-10-20-8-4-3-5-9-20)23-15-22(26-2)16-25(19,17-23)21-11-6-12-24(28)14-21;/h3-6,8-9,11-12,14,19,22-23,26,28H,7,10,13,15-18H2,1-2H3;1H/t19-,22+,23+,25+;/m1./s1
    MOLECULAR FORMULA
    C25H35ClN2O
    CROSS REFERENCES
    1970255 logo

    canSAR1970255

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 414.24
    AlogP 4.78
    HBond donors 2
    HBond acceptors 3
    Atoms 64
    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 canSAR1970255.