COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK159557
Chemical Name: 2-chloro-5-[3-(2,2-dicyanoethenyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoicacid
Smiles: N#CC(=Cc1cc(n(c1C)c1ccc(c(c1)C(=O)O)Cl)C)C#N

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Molecular Weight: 325.75
Empirical Formula: C17H12ClN3O2

Physical State: Dry powder
Available Amount: 381 mg

Lipinsky:
logP: 3.576
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 89
Number of rings: 2

     

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