COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582652
Chemical Name: 2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(4-nitrophenyl)ethanone
Smiles: Cc1ccc(cc1)c1[nH]nc(c1)c1nnc(n1N)SCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 435.47
Empirical Formula: C20H17N7O3S

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 3.85
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 173
Number of rings: 4

     

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