COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK169466
Chemical Name: methyl{4-[(Z)-(2-amino-3,7-dicyano-4,6-dimethyl-5H-cyclopenta[b]pyridin-5-ylidene)methyl]-2-bromophenoxy}acetate
Smiles: COC(=O)COc1ccc(cc1Br)/C=C\1/C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C

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Molecular Weight: 465.31
Empirical Formula: C22H17BrN4O3

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 5.366
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 3

     

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