COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280182
Chemical Name: 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: O=C(c1c(sc2c1CCCC2)NC(=O)c1ccccc1)OCCn1c(C)ncc1[N+](=O)[O-]

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Molecular Weight: 454.51
Empirical Formula: C22H22N4O5S

Physical State: Dry powder
Available Amount: 766 mg

Lipinsky:
logP: 6.114
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 4

     

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