COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK783468
Chemical Name: ethyl4-(1,3-benzodioxol-5-yl)-5-cyano-2-methyl-6-(1H-pyrrol-1-yl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(C)OC(=C(C1c1ccc2c(c1)OCO2)C#N)n1cccc1

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Molecular Weight: 378.38
Empirical Formula: C21H18N2O5

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 3.845
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 82
Number of rings: 4

     

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