COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK316618
Chemical Name: methyl3-({[4-nitro-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]carbonyl}amino)thiophene-2-carboxylate
Smiles: COC(=O)c1sccc1NC(=O)c1nn(cc1[N+](=O)[O-])C12CC3CC(C2)CC(C1)C3

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Molecular Weight: 430.48
Empirical Formula: C20H22N4O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.092
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 6

     

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