COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK061326
Chemical Name: 4-[(E)-(2-chlorophenyl)diazenyl]-3-(4-nitrophenyl)-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Smiles: NC(=S)N1N=C(C(C1=O)/N=N/c1ccccc1Cl)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 402.82
Empirical Formula: C16H11ClN6O3S

Physical State: Dry powder
Available Amount: 256 mg

Lipinsky:
logP: 2.319
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 161
Number of rings: 3

     

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