COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL415387
Chemical Name: 3,4-dinitro-1-(propan-2-yl)-1H-pyrazole-5-carboxylicacid
Smiles: CC(n1nc(c(c1C(=O)O)[N+](=O)[O-])[N+](=O)[O-])C

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Molecular Weight: 244.16
Empirical Formula: C7H8N4O6

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 0.984
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 146
Number of rings: 1

     

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