COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898899
Chemical Name: 2-{(E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}phenylacetate
Smiles: N#C/C(=C\c1ccccc1OC(=O)C)/c1scc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 390.42
Empirical Formula: C21H14N2O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.651
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 109
Number of rings: 4

     

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