COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK952797
Chemical Name: ethyl2-{[(2E)-3-(5-bromofuran-2-yl)-2-cyanoprop-2-enoyl]amino}-4-(4-fluorophenyl)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)/C(=C/c1ccc(o1)Br)/C#N

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Molecular Weight: 489.32
Empirical Formula: C21H14BrFN2O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 7.341
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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