COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539603
Chemical Name: (1S,5R)-3-[5-(1,2-dithiolan-3-yl)pentanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)CCCCC1CCSS1

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Molecular Weight: 378.56
Empirical Formula: C19H26N2O2S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.313
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 4

     

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