COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL401231
Chemical Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-2-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]benzamide
Smiles: N#Cc1c(NC(=O)c2ccccc2Cn2nc(c(c2C)[N+](=O)[O-])C)sc(c1CC)C

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Molecular Weight: 423.5
Empirical Formula: C21H21N5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.75
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 3

     

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