COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK218486
Chemical Name: 4-methoxy-N-{1-[4-methyl-5-({2-[(4-methyl-3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]ethyl}benzamide
Smiles: COc1ccc(cc1)C(=O)NC(c1nnc(n1C)SCC(=O)Nc1ccc(c(c1)[N+](=O)[O-])C)C

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Molecular Weight: 484.54
Empirical Formula: C22H24N6O5S

Physical State: Dry powder
Available Amount: 130 mg

Lipinsky:
logP: 3.825
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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