COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL392085
Chemical Name: 2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-N-(2-{[(E)-(5-nitrothiophen-2-yl)methylidene]amino}ethyl)acetamide
Smiles: O=C(Cn1nc(c(c1C)[N+](=O)[O-])C)NCC/N=C/c1ccc(s1)[N+](=O)[O-]

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Molecular Weight: 380.38
Empirical Formula: C14H16N6O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.493
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 179
Number of rings: 2

     

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