COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL160037
Chemical Name: 4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxo-2-({4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}methyl)butanoicacid
Smiles: COC(=O)c1sccc1NC(=O)CC(C(=O)O)CN1CCN(CC1)c1ccc(cn1)C(F)(F)F

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Molecular Weight: 500.5
Empirical Formula: C21H23F3N4O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.035
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 140
Number of rings: 3

     

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