COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK170874
Chemical Name: (5E)-2-amino-5-(3-chloro-4-ethoxybenzylidene)-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Smiles: CCOc1ccc(cc1Cl)/C=C/1\C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C

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Molecular Weight: 376.85
Empirical Formula: C21H17ClN4O

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 6.545
Rotatable bonds: 3
H-donors: 2
H-acceptors: 1
PSA: 95
Number of rings: 3

     

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