COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK147418
Chemical Name: N-{4-[4-methyl-5-({2-[(3-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}propanamide
Smiles: CCC(=O)Nc1ccc(cc1)c1nnc(n1C)SCC(=O)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 440.48
Empirical Formula: C20H20N6O4S

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 4.086
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 160
Number of rings: 3

     

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