COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL538014
Chemical Name: (12aS)-2-[2-(cyclohex-1-en-1-yl)ethyl]-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1CN(CCC2=CCCCC2)C(=O)[C@H]2N1C(c1ccc(cc1)C(C)C)c1c(C2)c2c([nH]1)cccc2

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Molecular Weight: 481.64
Empirical Formula: C31H35N3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.867
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 6

     

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