COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443833
Chemical Name: (2E)-3-(5-bromothiophen-2-yl)-2-cyano-N-(3-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(s1)Br)/C(=O)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 378.21
Empirical Formula: C14H8BrN3O3S

Physical State: Dry powder
Available Amount: 730 mg

Lipinsky:
logP: 4.5
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 2

     

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