COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706447
Chemical Name: ethyl4-(5-{(1Z)-2-cyano-3-[(1,1-dioxidotetrahydrothiophen-3-yl)amino]-3-oxoprop-1-en-1-yl}furan-2-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C(\C(=O)NC1CCS(=O)(=O)C1)/C#N

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Molecular Weight: 428.47
Empirical Formula: C21H20N2O6S

Physical State: Dry powder
Available Amount: 388 mg

Lipinsky:
logP: 1.797
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 134
Number of rings: 3

     

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