COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456178
Chemical Name: methyl5-(diethylcarbamoyl)-4-methyl-2-{[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamothioyl]amino}thiophene-3-carboxylate
Smiles: CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1nc2c(s1)CC(CC2)C)CC

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Molecular Weight: 480.68
Empirical Formula: C21H28N4O3S3

Physical State: Dry powder
Available Amount: 521 mg

Lipinsky:
logP: 8.036
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 172
Number of rings: 3

     

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