COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527771
Chemical Name: (12aR)-2-(2-hydroxy-2-phenylethyl)-6-phenyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: OC(c1ccccc1)CN1CC(=O)N2[C@@H](C1=O)Cc1c(C2c2ccccc2)[nH]c2c1cccc2

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Molecular Weight: 451.52
Empirical Formula: C28H25N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.003
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 76
Number of rings: 6

     

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