COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK754546
Chemical Name: 2-amino-1-(4-bromophenyl)-4-(4-methoxyphenyl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: COc1ccc(cc1)C1C(=C(N)N(C2=C1C(=O)CC(C2)(C)C)c1ccc(cc1)Br)C#N

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Molecular Weight: 478.39
Empirical Formula: C25H24BrN3O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.241
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 79
Number of rings: 4

     

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