COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL009842
Chemical Name: 2-(3,5-dimethyl-1H-pyrazol-1-yl)butanedioicacid
Smiles: Cc1cc(nn1C(C(=O)O)CC(=O)O)C

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Molecular Weight: 212.21
Empirical Formula: C9H12N2O4

Physical State: Dry powder
Available Amount: 1123 mg

Lipinsky:
logP: 1.083
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 92
Number of rings: 1

     

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