COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK461671
Chemical Name: methyl2-{[(4-fluoro-2-nitrophenyl)carbamothioyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2ccc(cc2[N+](=O)[O-])F)sc2c1CCCCC2

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Molecular Weight: 423.49
Empirical Formula: C18H18FN3O4S2

Physical State: Dry powder
Available Amount: 88 mg

Lipinsky:
logP: 6.597
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 156
Number of rings: 3

     

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