COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK307850
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[(5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]benzamide
Smiles: N#Cc1c(NC(=O)c2ccccc2Cn2nc(cc2C)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 421.48
Empirical Formula: C21H19N5O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.151
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 4

     

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