COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK131696
Chemical Name: 3,4-dimethoxy-N-{[5-({2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: C=CCn1c(CNC(=O)c2ccc(c(c2)OC)OC)nnc1SCC(=O)Nc1scc(n1)C

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Molecular Weight: 488.59
Empirical Formula: C21H24N6O4S2

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 3.176
Rotatable bonds: 10
H-donors: 2
H-acceptors: 4
PSA: 173
Number of rings: 3

     

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