COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL391904
Chemical Name: 1-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]-3-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]thiourea
Smiles: CCn1cc(c(n1)C)CNC(=S)Nc1c(C)nn(c1C)Cc1ccccc1C

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Molecular Weight: 396.56
Empirical Formula: C21H28N6S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 2.986
Rotatable bonds: 5
H-donors: 2
H-acceptors: 0
PSA: 91
Number of rings: 3

     

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