COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK794907
Chemical Name: 3-({4-[(E)-(2-amino-3,7-dicyano-4,6-dimethyl-5H-cyclopenta[b]pyridin-5-ylidene)methyl]phenoxy}methyl)benzoicacid
Smiles: N#CC1=C(C)/C(=C\c2ccc(cc2)OCc2cccc(c2)C(=O)O)/c2c1nc(N)c(c2C)C#N

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Molecular Weight: 448.48
Empirical Formula: C27H20N4O3

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 6.79
Rotatable bonds: 4
H-donors: 3
H-acceptors: 3
PSA: 133
Number of rings: 4

     

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