COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550057
Chemical Name: 7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-[4-(trifluoromethoxy)phenyl]-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione
Smiles: COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(cc1)OC(F)(F)F)c(=O)n(c(=O)n3C)C)Cl

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Molecular Weight: 647.99
Empirical Formula: C30H25ClF3N3O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.447
Rotatable bonds: 3
H-donors: 1
H-acceptors: 8
PSA: 127
Number of rings: 6

     

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