COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456221
Chemical Name: methyl5-(diethylcarbamoyl)-2-[(2,3-dihydro-1H-inden-5-ylcarbamothioyl)amino]-4-methylthiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1ccc2c(c1)CCC2)CC

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Molecular Weight: 445.61
Empirical Formula: C22H27N3O3S2

Physical State: Dry powder
Available Amount: 1059 mg

Lipinsky:
logP: 5.875
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 131
Number of rings: 3

     

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