COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443476
Chemical Name: methyl6-[(azepan-1-ylcarbonothioyl)amino]-3-chloro-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)N1CCCCCC1

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Molecular Weight: 382.93
Empirical Formula: C17H19ClN2O2S2

Physical State: Dry powder
Available Amount: 251 mg

Lipinsky:
logP: 4.957
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 101
Number of rings: 3

     

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