COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525769
Chemical Name: ethyl4-(4-bromophenyl)-2-{[(2E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoyl]amino}thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)/C(=C/c1ccc(cc1)OC)/C#N

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Molecular Weight: 511.4
Empirical Formula: C24H19BrN2O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.633
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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