COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK317452
Chemical Name: ethyl1-(3-bromophenyl)-5-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1cnn(c1NC(=O)c1sc2c(c1Cl)cccc2)c1cccc(c1)Br

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Molecular Weight: 504.79
Empirical Formula: C21H15BrClN3O3S

Physical State: Dry powder
Available Amount: 53 mg

Lipinsky:
logP: 8.271
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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