COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701551
Chemical Name: (2E)-2-(azepan-1-ylcarbonyl)-3-(1,3-diphenyl-1H-pyrazol-4-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(nc1c1ccccc1)c1ccccc1)/C(=O)N1CCCCCC1

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Molecular Weight: 396.49
Empirical Formula: C25H24N4O

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 5.011
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 61
Number of rings: 4

     

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