canSAR1087208
FEATURES
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NAMES
    SMILES
    C#CCN(C)[C@H](C)Cc1ccc(OCCCNc2c3c(nc4cc(Cl)ccc24)CCCC3)cc1
    InChI
    InChI=1S/C29H34ClN3O/c1-4-17-33(3)21(2)19-22-10-13-24(14-11-22)34-18-7-16-31-29-25-8-5-6-9-27(25)32-28-20-23(30)12-15-26(28)29/h1,10-15,20-21H,5-9,16-19H2,2-3H3,(H,31,32)/t21-/m1/s1
    MOLECULAR FORMULA
    C29H34ClN3O
    CROSS REFERENCES
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    canSAR1087208
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight475.24
    AlogP6.14
    HBond donors1
    HBond acceptors4
    Atoms68
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1087208.