COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK747524
Chemical Name: 2,6-diamino-4-(4-chloro-3-nitrophenyl)-4H-thiopyran-3,5-dicarbonitrile
Smiles: N#CC1=C(N)SC(=C(C1c1ccc(c(c1)[N+](=O)[O-])Cl)C#N)N

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Molecular Weight: 333.76
Empirical Formula: C13H8ClN5O2S

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 2.552
Rotatable bonds: 1
H-donors: 4
H-acceptors: 2
PSA: 170
Number of rings: 2

     

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