COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL062198
Chemical Name: ethyl6'-amino-5-bromo-5'-cyano-2'-(2-ethoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Smiles: CCOC(=O)C1=C(CC(=O)OCC)OC(=C(C21C(=O)Nc1c2cc(Br)cc1)C#N)N

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Molecular Weight: 476.28
Empirical Formula: C20H18BrN3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.837
Rotatable bonds: 7
H-donors: 3
H-acceptors: 6
PSA: 140
Number of rings: 3

     

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