COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK427029
Chemical Name: methyl4-(4-chlorophenyl)-2-{[2-(2,5-dichlorophenoxy)butanoyl]amino}thiophene-3-carboxylate
Smiles: CCC(C(=O)Nc1scc(c1C(=O)OC)c1ccc(cc1)Cl)Oc1cc(Cl)ccc1Cl

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Molecular Weight: 498.81
Empirical Formula: C22H18Cl3NO4S

Physical State: Dry powder
Available Amount: 726 mg

Lipinsky:
logP: 7.485
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 3

     

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