COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK438855
Chemical Name: ethyl2-[(azepan-1-ylcarbonothioyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)N2CCCCCC2)sc2c1CCCCCC2

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Molecular Weight: 394.6
Empirical Formula: C20H30N2O2S2

Physical State: Dry powder
Available Amount: 654 mg

Lipinsky:
logP: 7.363
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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