COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK891196
Chemical Name: 4-(4-bromophenyl)-6-oxo-2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: N#CC1=C(SCC(=O)c2cccs2)NC(=O)CC1c1ccc(cc1)Br

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Molecular Weight: 433.35
Empirical Formula: C18H13BrN2O2S2

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 4.727
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 123
Number of rings: 3

     

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