COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK586445
Chemical Name: {(3aR,4R,4aR,7aS,8R,8aR)-5,7-dioxo-3-[(E)-2-phenylethenyl]-3a,4,4a,5,7,7a,8,8a-octahydro-6H-4,8-methano[1,2]oxazolo[4,5-f]isoindol-6-yl}aceticacid
Smiles: OC(=O)CN1C(=O)[C@H]2[C@@H](C1=O)[C@@H]1C[C@H]2[C@H]2[C@@H]1ON=C2/C=C/c1ccccc1

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Molecular Weight: 366.37
Empirical Formula: C20H18N2O5

Physical State: Dry powder
Available Amount: 316 mg

Lipinsky:
logP: 1.397
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 5

     

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