COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112529
Chemical Name: (5Z)-2-amino-5-{3-methoxy-4-[(3-nitrobenzyl)oxy]benzylidene}-4,6-dimethyl-5H-cyclopenta[b]pyridine-3,7-dicarbonitrile
Smiles: COc1cc(ccc1OCc1cccc(c1)[N+](=O)[O-])/C=C\1/C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C

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Molecular Weight: 479.5
Empirical Formula: C27H21N5O4

Physical State: Dry powder
Available Amount: 144 mg

Lipinsky:
logP: 6.726
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 150
Number of rings: 4

     

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