COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK760952
Chemical Name: 2-amino-1-(2,5-dimethoxyphenyl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(c(c1)N1C(=C(C#N)C(C2=C1CCCC2=O)c1ccc(c(c1)O)OC)N)OC

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Molecular Weight: 447.49
Empirical Formula: C25H25N3O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.371
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 118
Number of rings: 4

     

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