COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547932
Chemical Name: (1S,5R)-3-{[5-(propan-2-yl)-2-(1H-pyrrol-1-yl)-1,3-thiazol-4-yl]carbonyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: CC(c1sc(nc1C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)n1cccc1)C

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Molecular Weight: 408.52
Empirical Formula: C22H24N4O2S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.181
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 86
Number of rings: 5

     

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