COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK895714
Chemical Name: 5-tert-butylbenzene-1,3-dicarboxylicacid
Smiles: OC(=O)c1cc(cc(c1)C(C)(C)C)C(=O)O

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Molecular Weight: 222.24
Empirical Formula: C12H14O4

Physical State: Dry powder
Available Amount: 982 mg

Lipinsky:
logP: 3.348
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 74
Number of rings: 1

     

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