COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK316316
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-N-[3-nitro-5-(pyridin-2-ylsulfanyl)phenyl]prop-2-enamide
Smiles: COc1ccc(cc1OC)/C=C/C(=O)Nc1cc(Sc2ccccn2)cc(c1)[N+](=O)[O-]

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Molecular Weight: 437.48
Empirical Formula: C22H19N3O5S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 5.467
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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