COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904622
Chemical Name: (2E)-2-cyano-3-{3-[3-(diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(3-methoxypropyl)prop-2-enamide
Smiles: COCCCNC(=O)/C(=C/c1cn(nc1c1cccc(c1)S(=O)(=O)N(CC)CC)c1ccccc1)/C#N

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Molecular Weight: 521.64
Empirical Formula: C27H31N5O4S

Physical State: Dry powder
Available Amount: 401 mg

Lipinsky:
logP: 3.578
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 125
Number of rings: 3

     

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