COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL021699
Chemical Name: 4-(2-aminoethyl)-5-[2-(methylsulfanyl)phenyl]-1,2-dihydro-3H-pyrazol-3-one
Smiles: NCCc1c(=O)[nH][nH]c1c1ccccc1SC

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Molecular Weight: 249.34
Empirical Formula: C12H15N3OS

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 2.181
Rotatable bonds: 4
H-donors: 4
H-acceptors: 1
PSA: 92
Number of rings: 2

     

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