COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK780179
Chemical Name: 4-[(2-methylbutan-2-yl)amino]-3-nitro-2H-thiochromen-2-one
Smiles: CCC(Nc1c([N+](=O)[O-])c(=O)sc2c1cccc2)(C)C

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Molecular Weight: 292.36
Empirical Formula: C14H16N2O3S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 2.741
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 100
Number of rings: 2

     

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