COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK250679
Chemical Name: N-(4-acetylphenyl)-4,4-dimethyl-3,8-dioxo-1-sulfanyl-3,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazine-6-carboxamide
Smiles: O=C(C1CC(=O)N2N1C(C)(C)C(=O)N=C2S)Nc1ccc(cc1)C(=O)C

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Molecular Weight: 374.42
Empirical Formula: C17H18N4O4S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 0.801
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 137
Number of rings: 3

     

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