COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL552033
Chemical Name: (2S,8'R)-2'-amino-7-chloro-4'-hydroxy-4,6-dimethoxy-8'-methyl-5'-(3,4,5-trimethoxyphenyl)-5',8',9',10'-tetrahydro-3H,6'H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-3,6'-dione
Smiles: COc1cc(OC)c(c2c1C(=O)[C@]1(O2)[C@H](C)CC2=C(C1=O)C(c1cc(OC)c(c(c1)OC)OC)c1c(N2)nc(nc1O)N)Cl

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Molecular Weight: 625.03
Empirical Formula: C30H29ClN4O9

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.393
Rotatable bonds: 5
H-donors: 4
H-acceptors: 9
PSA: 173
Number of rings: 6

     

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