COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434986
Chemical Name: 2-methyl-5-(propan-2-yl)benzenesulfonicacid
Smiles: CC(c1ccc(c(c1)S(=O)(=O)O)C)C

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Molecular Weight: 214.29
Empirical Formula: C10H14O3S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 2.269
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 62
Number of rings: 1

     

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