COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526785
Chemical Name: methyl(3aS,4S,7R,7aS)-8-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-4,7-(epiminomethano)-2-benzofuran-9-carboxylate
Smiles: COC(=O)N1C(C)[C@H]2C=C[C@@H]1[C@@H]1[C@H]2C(=O)OC1=O

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Molecular Weight: 251.24
Empirical Formula: C12H13NO5

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: -0.041
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 72
Number of rings: 4

     

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