COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK456859
Chemical Name: methyl2-{[(4-chloro-2,5-dimethoxyphenyl)carbamothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COc1cc(Cl)c(cc1NC(=S)Nc1sc2c(c1C(=O)OC)CCCCC2)OC

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Molecular Weight: 455
Empirical Formula: C20H23ClN2O4S2

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 7.378
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 129
Number of rings: 3

     

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