COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK436651
Chemical Name: methyl4-ethyl-5-methyl-2-({[2-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonyl)hydrazinyl]carbonothioyl}amino)thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)NNC(=O)c2cc3c(s2)CCCCC3)sc(c1CC)C

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Molecular Weight: 451.63
Empirical Formula: C20H25N3O3S3

Physical State: Dry powder
Available Amount: 460 mg

Lipinsky:
logP: 7.351
Rotatable bonds: 5
H-donors: 3
H-acceptors: 3
PSA: 168
Number of rings: 3

     

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