COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549806
Chemical Name: ethyl2-{[({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
Smiles: C=CCn1c(SCC(=O)Nc2nc(c(s2)C(=O)OCC)C)nnc1CSc1nc2c(s1)cccc2

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Molecular Weight: 546.72
Empirical Formula: C22H22N6O3S4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.217
Rotatable bonds: 11
H-donors: 1
H-acceptors: 3
PSA: 218
Number of rings: 4

     

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