COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524510
Chemical Name: (1S)-3-{5-[bis(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-2-methoxybenzyl}-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Smiles: COc1ccc(cc1CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)C(C1=C(O)CC(CC1=O)(C)C)C1=C(O)CC(CC1=O)(C)C

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Molecular Weight: 600.76
Empirical Formula: C36H44N2O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.278
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 107
Number of rings: 6

     

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