COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK154217
Chemical Name: 1-(4-chlorophenyl)-2-{[4-methyl-5-(4-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc(n1C)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 388.83
Empirical Formula: C17H13ClN4O3S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.989
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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