COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK418016
Chemical Name: ethyl2-{[(3,4,5-triethoxyphenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(OCC)c(c(c2)OCC)OCC)sc2c1CCCCC2

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Molecular Weight: 475.61
Empirical Formula: C25H33NO6S

Physical State: Dry powder
Available Amount: 2268 mg

Lipinsky:
logP: 8.417
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 111
Number of rings: 3

     

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