COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL379698
Chemical Name: 2-amino-4-[3-bromo-5-methoxy-4-(prop-2-en-1-yloxy)phenyl]-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Smiles: C=CCOc1c(Br)cc(cc1OC)C1C(=C(N)OC2=C1C(=O)CCC2)C#N

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Molecular Weight: 431.29
Empirical Formula: C20H19BrN2O4

Physical State: Dry powder
Available Amount: 612 mg

Lipinsky:
logP: 2.582
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 94
Number of rings: 3

     

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