COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK961266
Chemical Name: ethyl4-(2-chlorocyclohexa-1,3-dien-1-yl)-2-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)amino]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(scc1C1=C(Cl)C=CCC1)NC(=O)c1csc2c1CCCC2

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Molecular Weight: 448.01
Empirical Formula: C22H22ClNO3S2

Available Amount: 0 mg

Lipinsky:
logP: 7.845
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 4

     

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