COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552089
Chemical Name: ethyl2-{4-[(2S,8'R)-7-chloro-4'-hydroxy-4,6-dimethoxy-8'-methyl-2',3,6'-trioxo-1',5',6',8',9',10'-hexahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinolin]-5'-yl]phenoxy}-4-methyl-1,3-thiazol
Smiles: CCOC(=O)c1sc(nc1C)Oc1ccc(cc1)C1C2=C(C[C@H]([C@@]3(C2=O)Oc2c(C3=O)c(OC)cc(c2Cl)OC)C)Nc2c1c(O)nc(=O)[nH]2

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Molecular Weight: 721.14
Empirical Formula: C34H29ClN4O10S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.238
Rotatable bonds: 7
H-donors: 3
H-acceptors: 10
PSA: 212
Number of rings: 7

     

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