COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539068
Chemical Name: (1S,5R)-3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-oxoethyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(c1ccc2c(c1)OCCCO2)CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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Molecular Weight: 380.44
Empirical Formula: C22H24N2O4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.454
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 5

     

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