COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK180201
Chemical Name: (2E)-3-[1-(4-tert-butylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-methylprop-2-enamide
Smiles: CNC(=O)/C(=C/c1cc(n(c1C)c1ccc(cc1)C(C)(C)C)C)/C#N

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Molecular Weight: 335.45
Empirical Formula: C21H25N3O

Physical State: Dry powder
Available Amount: 156 mg

Lipinsky:
logP: 4.572
Rotatable bonds: 2
H-donors: 1
H-acceptors: 1
PSA: 57
Number of rings: 2

     

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