COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL010444
Chemical Name: methylN-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonyl}-D-valinate
Smiles: COC(=O)[C@@H](C(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 347.41
Empirical Formula: C18H25N3O4

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 1.265
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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