COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK182375
Chemical Name: (2Z)-3-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide
Smiles: CCOc1ccc(cc1)NC(=O)/C(=C\c1cc(n(c1C)c1ccc2c(c1)OCO2)C)/C#N

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Molecular Weight: 429.48
Empirical Formula: C25H23N3O4

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 5.509
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 85
Number of rings: 4

     

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