COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549934
Chemical Name: 7-chloro-9'-(4-hydroxyphenyl)-4,6-dimethoxy-6'-methyl-1',5',6',9'-tetrahydro-3H,8'H-spiro[1-benzofuran-2,7'-[1,2,4]triazolo[5,1-b]quinazoline]-3,8'-dione
Smiles: COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=C(C1=O)C(c1ccc(cc1)O)n1c(=N2)nc[nH]1)Cl

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Molecular Weight: 508.92
Empirical Formula: C25H21ClN4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.68
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 122
Number of rings: 6

     

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