COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK958050
Chemical Name: ethyl2-({[1-(4-chlorobenzyl)-3-nitro-1H-pyrazol-5-yl]carbonyl}amino)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(nn2Cc2ccc(cc2)Cl)[N+](=O)[O-])sc2c1CCC(C2)C

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Molecular Weight: 502.98
Empirical Formula: C23H23ClN4O5S

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 6.777
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 4

     

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