COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL548663
Chemical Name: (12bS)-2-(3-chlorobenzyl)-9-fluoro-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Smiles: Fc1ccc2c(c1)c1CCN3[C@](c1[nH]2)(C)C(=O)N(CC3=O)Cc1cccc(c1)Cl

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Molecular Weight: 411.86
Empirical Formula: C22H19ClFN3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.032
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 5

     

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