canSAR1846476
FEATURES
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NAMES
    SMILES
    Cl.Cl.NC1CCc2c(c3cc(OCCc4ccc(O)cc4)ccc3n2CCCCCc2ccccn2)C1
    InChI
    InChI=1S/C30H35N3O2.2ClH/c31-23-10-14-29-27(20-23)28-21-26(35-19-16-22-8-11-25(34)12-9-22)13-15-30(28)33(29)18-5-1-2-6-24-7-3-4-17-32-24;;/h3-4,7-9,11-13,15,17,21,23,34H,1-2,5-6,10,14,16,18-20,31H2;2*1H
    MOLECULAR FORMULA
    C30H37Cl2N3O2
    CROSS REFERENCES
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    canSAR1846476
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight541.23
    AlogP6.44
    HBond donors3
    HBond acceptors5
    Atoms74
    Contains toxicophoreNo
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846476.