COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673049
Chemical Name: (1S,2R,4S,6R)-3-(thiophen-2-ylcarbonyl)-7,9-dioxatricyclo[4.2.1.0~2,4~]nonan-5-one
Smiles: O=C1[C@@H]2OC[C@@H](O2)[C@@H]2C1[C@@H]2C(=O)c1cccs1

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Molecular Weight: 250.27
Empirical Formula: C12H10O4S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 0.232
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 80
Number of rings: 4

     

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