COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK776475
Chemical Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(4-nitro-1H-pyrazol-1-yl)butanamide
Smiles: N#Cc1c(NC(=O)CCCn2ncc(c2)[N+](=O)[O-])sc2c1CCCC2

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Molecular Weight: 359.41
Empirical Formula: C16H17N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.821
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 144
Number of rings: 3

     

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