COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK250680
Chemical Name: butyl4-{[(4,4-dimethyl-3,8-dioxo-1-sulfanyl-3,4,7,8-tetrahydro-6H-pyrazolo[1,2-a][1,2,4]triazin-6-yl)carbonyl]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)C1CC(=O)N2N1C(C)(C)C(=O)N=C2S

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Molecular Weight: 432.5
Empirical Formula: C20H24N4O5S

Physical State: Dry powder
Available Amount: 419 mg

Lipinsky:
logP: 2.946
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 147
Number of rings: 3

     

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