COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK305435
Chemical Name: methyl2-({[5-methyl-4-nitro-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)Cn2nc(c(c2C)[N+](=O)[O-])C(F)(F)F)sc2c1CCCC2

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Molecular Weight: 446.41
Empirical Formula: C17H17F3N4O5S

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 5.174
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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