COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK676557
Chemical Name: 1-(2,4-dimethylphenyl)-2,5-dioxopyrrolidin-3-ylN-{4-[chloro(difluoro)methoxy]phenyl}-N'-(2-phenylethyl)carbamimidothioate
Smiles: Cc1ccc(c(c1)C)N1C(=O)CC(C1=O)S/C(=N/CCc1ccccc1)/Nc1ccc(cc1)OC(Cl)(F)F

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Saltdata: AcOH(2:1)
Molecular Weight: 558.05
Empirical Formula: C28H26ClF2N3O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.727
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 4

     

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