COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL536590
Chemical Name: (12aS)-6-(4-chlorophenyl)-2-heptyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: CCCCCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Cl)[nH]c2c1cccc2

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Molecular Weight: 464.01
Empirical Formula: C27H30ClN3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.351
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 56
Number of rings: 5

     

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