COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK418683
Chemical Name: ethyl6-ethyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)C2c3ccccc3Oc3c2cccc3)sc2c1CCC(C2)CC

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Molecular Weight: 461.58
Empirical Formula: C27H27NO4S

Physical State: Dry powder
Available Amount: 1463 mg

Lipinsky:
logP: 7.905
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 92
Number of rings: 5

     

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