COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549527
Chemical Name: (2S,6'R)-7-chloro-9'-(2-hydroxy-7-methoxyquinolin-3-yl)-4,6-dimethoxy-6'-methyl-4',5',6',9'-tetrahydro-3H,8'H-spiro[1-benzofuran-2,7'-[1,2,4]triazolo[5,1-b]quinazoline]-3,8'-dione
Smiles: COc1ccc2c(c1)nc(c(c2)C1n2ncnc2NC2=C1C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)O

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Molecular Weight: 589.99
Empirical Formula: C29H24ClN5O7

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.318
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 146
Number of rings: 7

     

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