COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK961571
Chemical Name: 2-amino-4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Smiles: N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(c(c1)COc1ccc(cc1Cl)Br)OC)(C#N)C#N

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Molecular Weight: 549.85
Empirical Formula: C27H22BrClN4O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.448
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 115
Number of rings: 4

     

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