COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL458070
Chemical Name: methyl4,5-dimethoxy-2-({[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonyl}amino)benzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)OC

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Molecular Weight: 427.46
Empirical Formula: C22H25N3O6

Available Amount: 0 mg

Lipinsky:
logP: 2.443
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 97
Number of rings: 4

     

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