COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK025787
Chemical Name: methyl4-{[({5-[(4-methoxybenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COc1ccc(cc1)CSc1nnc(s1)SCC(=O)Nc1ccc(cc1)C(=O)OC

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Molecular Weight: 461.59
Empirical Formula: C20H19N3O4S3

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 5.823
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 169
Number of rings: 3

     

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