COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK040270
Chemical Name: 3,4-dimethyl-N-[(E)-(5-nitrothiophen-2-yl)methylidene]aniline
Smiles: Cc1cc(/N=C/c2ccc(s2)[N+](=O)[O-])ccc1C

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Molecular Weight: 260.32
Empirical Formula: C13H12N2O2S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 3.347
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 2

     

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