COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK119319
Chemical Name: N-{1-[4-ethyl-5-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-2-methylpropyl}benzamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2)[N+](=O)[O-])nnc1C(C(C)C)NC(=O)c1ccccc1

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Molecular Weight: 482.56
Empirical Formula: C23H26N6O4S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 4.799
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 160
Number of rings: 3

     

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