COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473746
Chemical Name: N-(1,3-benzothiazol-2-yl)-2-{[5-(2-ethoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)Nc2nc3c(s2)cccc3)nnc1c1ccccc1OCC

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Molecular Weight: 451.57
Empirical Formula: C22H21N5O2S2

Physical State: Dry powder
Available Amount: 326 mg

Lipinsky:
logP: 5.72
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 135
Number of rings: 4

     

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