COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272964
Chemical Name: 2-[3-(1H-benzotriazol-1-ylmethyl)-4-(prop-2-en-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-N-(3-chloro-2-methylphenyl)acetamide
Smiles: C=CCn1c(nn(c1=S)CC(=O)Nc1cccc(c1C)Cl)Cn1nnc2c1cccc2

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Molecular Weight: 453.96
Empirical Formula: C21H20ClN7OS

Available Amount: 0 mg

Lipinsky:
logP: 2.905
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 110
Number of rings: 4

     

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