COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527856
Chemical Name: (12aR)-2-pentyl-6-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCN1CC(=O)N2[C@@H](C1=O)Cc1c(C2CCc2ccccc2)[nH]c2c1cccc2

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Molecular Weight: 429.56
Empirical Formula: C27H31N3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.648
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 5

     

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