COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537309
Chemical Name: (1S,5S)-N-[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)N[C@H](C(=O)Nc1ccc2c(c1)OCCO2)C(C)C

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Molecular Weight: 466.54
Empirical Formula: C25H30N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.186
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 5

     

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