COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK961507
Chemical Name: ethyl2-[({[2-chloro-5-(methylsulfanyl)phenyl]carbonyl}carbamothioyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=S)NC(=O)c2cc(SC)ccc2Cl)sc2c1CCCCC2

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Molecular Weight: 483.08
Empirical Formula: C21H23ClN2O3S3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.176
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 153
Number of rings: 3

     

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