COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK908114
Chemical Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-5-[4-(propan-2-yl)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: O=C1C(=C(C(N1c1nnc(s1)SCc1ccccc1F)c1ccc(cc1)C(C)C)C(=O)c1ccc2c(c1)OCCO2)O

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Molecular Weight: 603.7
Empirical Formula: C31H26FN3O5S2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 7.449
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 6

     

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