COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK763195
Chemical Name: ethyl2-({[2-(azepan-1-yl)-5-nitrophenyl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(ccc2N2CCCCCC2)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 471.58
Empirical Formula: C24H29N3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.204
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 132
Number of rings: 4

     

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