COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378019
Chemical Name: methylN-[(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbamoyl]-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate
Smiles: COC(=O)C(C(F)(F)F)(Oc1ccc(cc1)F)NC(=O)Nc1sc2c(c1C(=O)N)CCCC2

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Molecular Weight: 489.45
Empirical Formula: C20H19F4N3O5S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 8.362
Rotatable bonds: 5
H-donors: 4
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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