COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380360
Chemical Name: 4-[3-(2,2-dicyanoethenyl)-2,5-dimethyl-1H-pyrrol-1-yl]benzoicacid
Smiles: N#CC(=Cc1cc(n(c1C)c1ccc(cc1)C(=O)O)C)C#N

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Molecular Weight: 291.31
Empirical Formula: C17H13N3O2

Physical State: Dry powder
Available Amount: 229 mg

Lipinsky:
logP: 3.432
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 89
Number of rings: 2

     

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