COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK908123
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-5-(2-fluorophenyl)-3-hydroxy-1-{5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)CSc1nnc(s1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 575.64
Empirical Formula: C29H22FN3O5S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 6.571
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 6

     

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