COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524408
Chemical Name: ethyl4-(4-bromophenyl)-2-({(2E)-2-cyano-3-[4-(propan-2-yl)phenyl]prop-2-enoyl}amino)thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)/C(=C/c1ccc(cc1)C(C)C)/C#N

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Molecular Weight: 523.45
Empirical Formula: C26H23BrN2O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 9.027
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 107
Number of rings: 3

     

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