COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK815870
Chemical Name: 4-[(4-butoxyphenyl)carbonyl]-1-{5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-5-[4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCCOc1ccc(cc1)C1C(=C(C(=O)N1c1nnc(s1)SCc1ccccc1Cl)O)C(=O)c1ccc(cc1)OCCCC

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Molecular Weight: 678.27
Empirical Formula: C35H36ClN3O5S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 10.289
Rotatable bonds: 12
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 5

     

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