COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219932
Chemical Name: ethyl3-({[(4-chlorophenyl)sulfanyl]acetyl}amino)-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(c(c1)NC(=O)CSc1ccc(cc1)Cl)N1CCN(CC1)C(=O)c1ccccc1

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Molecular Weight: 538.07
Empirical Formula: C28H28ClN3O4S

Physical State: Dry powder
Available Amount: 263 mg

Lipinsky:
logP: 4.622
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 4

     

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