COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK428747
Chemical Name: (2E)-4-{[3-(methoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]amino}-2-methyl-4-oxobut-2-enoicacid
Smiles: COC(=O)c1c(NC(=O)/C=C(/C(=O)O)\C)sc2c1CCCCC2

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Molecular Weight: 337.4
Empirical Formula: C16H19NO5S

Physical State: Dry powder
Available Amount: 325 mg

Lipinsky:
logP: 5.525
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 2

     

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