COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK455684
Chemical Name: 1-[2-(4-bromo-1H-pyrazol-1-yl)ethyl]-3-(2-methoxy-4-nitrophenyl)thiourea
Smiles: COc1cc(ccc1NC(=S)NCCn1ncc(c1)Br)[N+](=O)[O-]

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Molecular Weight: 400.26
Empirical Formula: C13H14BrN5O3S

Physical State: Dry powder
Available Amount: 414 mg

Lipinsky:
logP: 2.929
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 129
Number of rings: 2

     

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