COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL551340
Chemical Name: 5'-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-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(o1)c1nc2c(s1)cccc2)c(=O)n(c(=O)n3C)C)Cl

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Molecular Weight: 687.13
Empirical Formula: C34H27ClN4O8S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 7.33
Rotatable bonds: 5
H-donors: 1
H-acceptors: 8
PSA: 172
Number of rings: 8

     

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