COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675670
Chemical Name: methyl4-[3-({N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[3-(trifluoromethyl)phenyl]carbamimidoyl}sulfanyl)-2,5-dioxopyrrolidin-1-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=O)CC(C1=O)S/C(=N\c1cccc(c1)C(F)(F)F)/NCCc1ccc(c(c1)OC)OC

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Molecular Weight: 615.63
Empirical Formula: C30H28F3N3O6S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.737
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 131
Number of rings: 4

     

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