COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565074
Chemical Name: 2-(4-methoxy-3-{[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}phenyl)-1,3-thiazolidine-4-carboxylicacid
Smiles: COc1ccc(cc1CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C1SCC(N1)C(=O)O

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Saltdata: 2 CH3COOH
Molecular Weight: 441.55
Empirical Formula: C23H27N3O4S

Physical State: Dry powder
Available Amount: 9 mg

Lipinsky:
logP: 1.321
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 107
Number of rings: 5

     

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