COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK611986
Chemical Name: 2-[2,6,8-trioxo-10-(thiophen-2-yl)-3,4a,5,5a,6,8,8a,9,9a,10-decahydro-5,9-methano[1,3]thiazolo[5',4':5,6]thiopyrano[2,3-f]isoindol-7(2H)-yl]propanoicacid
Smiles: O=c1sc2c([nH]1)SC1C(C2c2cccs2)C2CC1C1C2C(=O)N(C1=O)C(C(=O)O)C

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Molecular Weight: 462.57
Empirical Formula: C20H18N2O5S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.783
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 182
Number of rings: 6

     

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