COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK169478
Chemical Name: 3-({4-[(Z)-(2-amino-3,7-dicyano-4,6-dimethyl-5H-cyclopenta[b]pyridin-5-ylidene)methyl]-2-methoxyphenoxy}methyl)benzoicacid
Smiles: COc1cc(ccc1OCc1cccc(c1)C(=O)O)/C=C\1/C(=C(c2c1c(C)c(c(n2)N)C#N)C#N)C

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Molecular Weight: 478.51
Empirical Formula: C28H22N4O4

Physical State: Dry powder
Available Amount: 242 mg

Lipinsky:
logP: 6.672
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 142
Number of rings: 4

     

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