COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552601
Chemical Name: {4-[(2S,8'R)-7-chloro-4'-hydroxy-4,6-dimethoxy-1',8'-dimethyl-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]-2-methoxyphenoxy}aceticacid
Smiles: COc1cc(ccc1OCC(=O)O)C1C2=C(C[C@H]([C@@]3(C2=O)Oc2c(C3=O)c(OC)cc(c2Cl)OC)C)Nc2c1c(O)nc(=O)n2C

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Molecular Weight: 654.03
Empirical Formula: C31H28ClN3O11

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.228
Rotatable bonds: 9
H-donors: 3
H-acceptors: 11
PSA: 182
Number of rings: 6

     

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