COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK457631
Chemical Name: methyl2-{[(2'-nitrobiphenyl-4-yl)carbamothioyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=S)Nc2ccc(cc2)c2ccccc2[N+](=O)[O-])sc2c1CCC2

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Molecular Weight: 453.54
Empirical Formula: C22H19N3O4S2

Physical State: Dry powder
Available Amount: 426 mg

Lipinsky:
logP: 6.48
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 156
Number of rings: 4

     

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