COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL550847
Chemical Name: (2S,8'R)-7-chloro-5'-(3,4-dimethoxyphenyl)-4'-hydroxy-4,6-dimethoxy-1',8'-dimethyl-5',8',9',10'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,6'(1'H)-trione
Smiles: COc1cc(ccc1OC)C1c2c(O)nc(=O)n(c2NC2=C1C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)C

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Molecular Weight: 610.02
Empirical Formula: C30H28ClN3O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.021
Rotatable bonds: 6
H-donors: 2
H-acceptors: 9
PSA: 145
Number of rings: 6

     

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