COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527182
Chemical Name: (6R,12aR)-2-(5-hydroxypentyl)-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OCCCCCN1CC(=O)N2[C@@H](C1=O)Cc1c([C@H]2c2ccccc2)[nH]c2c1cccc2

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Molecular Weight: 417.51
Empirical Formula: C25H27N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.687
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 76
Number of rings: 5

     

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