COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK028915
Chemical Name: 2-amino-4-(4-butoxy-3-methoxyphenyl)-6-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}pyridine-3,5-dicarbonitrile
Smiles: CCCCOc1ccc(cc1OC)c1c(C#N)c(N)nc(c1C#N)SCC(=O)C12CC3CC(C2)CC(C1)C3

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Saltdata: 0.1 DMF
Molecular Weight: 530.69
Empirical Formula: C30H34N4O3S

Physical State: Dry powder
Available Amount: 364 mg

Lipinsky:
logP: 7.724
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 147
Number of rings: 6

     

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