COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959552
Chemical Name: 2-methoxyethyl2-{[(4-methyl-3,5-dinitrophenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COCCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C

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Molecular Weight: 463.47
Empirical Formula: C20H21N3O8S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.52
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 184
Number of rings: 3

     

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