COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK309803
Chemical Name: N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]azepane-1-carbothioamide
Smiles: S=C(N1CCCCCC1)Nc1c(C)nn(c1C)Cc1ccccc1C

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Molecular Weight: 356.54
Empirical Formula: C20H28N4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.988
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 65
Number of rings: 3

     

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