COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443581
Chemical Name: 2-(3,5-dimethylbenzyl)butanedioicacid
Smiles: OC(=O)C(Cc1cc(C)cc(c1)C)CC(=O)O

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Molecular Weight: 236.27
Empirical Formula: C13H16O4

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 2.52
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 74
Number of rings: 1

     

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