COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK463858
Chemical Name: ethyl3-{[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1cccc(c1)NC(=O)c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-]

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Molecular Weight: 404.83
Empirical Formula: C18H13ClN2O5S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 5.469
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 129
Number of rings: 3

     

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