COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK515983
Chemical Name: 1-{5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-3-hydroxy-4-(thiophen-2-ylcarbonyl)-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1cc(cc(c1OC)OC)C1N(c2nnc(s2)SCc2ccc(cc2)F)C(=O)C(=C1C(=O)c1cccs1)O

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Molecular Weight: 599.68
Empirical Formula: C27H22FN3O6S3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.986
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 192
Number of rings: 5

     

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