COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL369925
Chemical Name: methyl2-amino-4-(5-bromo-2-ethoxyphenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Smiles: CCOc1ccc(cc1C1C(=C(N)OC2=C1C(=O)CC(C2)(C)C)C(=O)OC)Br

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Molecular Weight: 450.33
Empirical Formula: C21H24BrNO5

Physical State: Dry powder
Available Amount: 1010 mg

Lipinsky:
logP: 3.714
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 87
Number of rings: 3

     

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