COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK034475
Chemical Name: (2E)-3-(4-hexylphenyl)but-2-enoicacid
Smiles: CCCCCCc1ccc(cc1)/C(=C/C(=O)O)/C

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Molecular Weight: 246.35
Empirical Formula: C16H22O2

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 6.081
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 37
Number of rings: 1

     

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