COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528904
Chemical Name: (12aS)-2-(1-benzylpiperidin-4-yl)-6-(3-bromophenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: Brc1cccc(c1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C1CCN(CC1)Cc1ccccc1

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Molecular Weight: 583.53
Empirical Formula: C32H31BrN4O2

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 4.364
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 59
Number of rings: 7

     

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