COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK858622
Chemical Name: N-[3-(4-methyl-5-{[2-(4-nitrophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)phenyl]propanamide
Smiles: CCC(=O)Nc1cccc(c1)c1nnc(n1C)SCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 425.47
Empirical Formula: C20H19N5O4S

Physical State: Dry powder
Available Amount: 107 mg

Lipinsky:
logP: 3.843
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 148
Number of rings: 3

     

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