COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK516517
Chemical Name: 1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(furan-2-ylcarbonyl)-3-hydroxy-5-(thiophen-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)CSc1nnc(s1)N1C(=O)C(=C(C1c1cccs1)C(=O)c1ccco1)O

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Saltdata: 1/5CH3COOH
Molecular Weight: 499.57
Empirical Formula: C22H14FN3O4S3

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 4.328
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 178
Number of rings: 5

     

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