COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK881049
Chemical Name: (2Z)-2-(morpholin-4-ylcarbonyl)-3-{1-phenyl-3-[4-(propylsulfanyl)phenyl]-1H-pyrazol-4-yl}prop-2-enenitrile
Smiles: CCCSc1ccc(cc1)c1nn(cc1/C=C(\C(=O)N1CCOCC1)/C#N)c1ccccc1

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Molecular Weight: 458.58
Empirical Formula: C26H26N4O2S

Physical State: Dry powder
Available Amount: 393 mg

Lipinsky:
logP: 4.449
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 96
Number of rings: 4

     

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