COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL004112
Chemical Name: 3-[(4-iodo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-methoxybenzoicacid
Smiles: COc1ccc(cc1Cn1nc(c(c1C)I)C)C(=O)O

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Molecular Weight: 386.19
Empirical Formula: C14H15IN2O3

Physical State: Dry powder
Available Amount: 2297 mg

Lipinsky:
logP: 3.825
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 64
Number of rings: 2

     

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