COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK816469
Chemical Name: 4-[(4-butoxyphenyl)carbonyl]-1-{5-[(2-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-5-(3-nitrophenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCOc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1nnc(s1)SCc1ccccc1F

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Molecular Weight: 620.68
Empirical Formula: C30H25FN4O6S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 7.434
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 191
Number of rings: 5

     

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