COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK602634
Chemical Name: trans-4-{[({[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)amino]methyl}cyclohexanecarboxylicacid
Smiles: O=C(COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O)NC[C@@H]1CC[C@H](CC1)C(=O)O

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Molecular Weight: 441.5
Empirical Formula: C23H23NO6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.124
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 4

     

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