COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK453620
Chemical Name: 3-{[4-(4-butylphenyl)-3-(ethoxycarbonyl)thiophen-2-yl]carbamoyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylicacid
Smiles: CCCCc1ccc(cc1)c1csc(c1C(=O)OCC)NC(=O)C1C2CCC(C1C(=O)O)O2

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Molecular Weight: 471.57
Empirical Formula: C25H29NO6S

Physical State: Dry powder
Available Amount: 991 mg

Lipinsky:
logP: 5.502
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 130
Number of rings: 4

     

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